para-tert-butyl cyclohexanone
cyclohexanone, 4-(1,1-dimethylethyl)-
 
Notes:
None found
  • Augustus Oils
    • Augustus Oils Ltd
      The Premier Supplier
      Augustus Oils Ltd, in harmony with nature - to present it at its best...
      A wealth of experience, expertise and knowledge has allowed Augustus to bridge the gulf in expectation and trust between growers and users of natural ingredients. The Company works in partnership with customers on the one hand, and growers, farmers and distillers on the other. Both users and producers can then focus on exactly what they do best, while skilled Augustus technicians closely monitor and control the delivered product. This ensures users can have the confidence that they will receive the best raw materials suited to their requirements.
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      Para Tert Butylcyclohexanone
       
  • Berjé
    • Berje Inc.
      Where the world comes to its senses
      Where the world comes to its senses - Berjé is a global distributor of Essential Oils and Aromatic Chemicals.
      Berjé is a family-owned business that has been in operation for six decades. The company's origins and strength lie in a profound understanding of the supply and the quality of the diverse raw materials consumed by the flavor and fragrance industries. This base was expanded upon more than two decades ago to include fragrance production. The company's unparalleled raw material expertise is focused on the supply of essential oils and aromatic chemicals. This is supported by our long-standing relationships with a worldwide fabric of producers ensuring the greatest prospects for uninterrupted supply in markets that are often volatile and unpredictable.
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      Product(s):
      P.T.B.C. Hexanone
       
  • BOC Sciences
    • BOC Sciences
      Best of Chemicals Supplier
      Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecule and chiral compounds.
      BOC Sciences provides a wide range of services to support the pharmaceutical industry through all stages of drug discovery including Custom Synthesis of those chemicals that are not in stock, Isotope Labeling Service, Chiral Synthesis and Resolution, Bioconjugation, PEGylation services, analytical services.
      BOC Sciences is a brand of BOCSCI Inc. We leverage our wide spectrum of business in the fields of development, manufacturing, marketing, and distribution to help you make best-informed decisions tailored to your evolving needs for premium chemicals. Our complete suite of CRO services spans the entire molecule development pipeline including contract research for target identification, building blocks, compound synthesis, biochemical and cellular analysis, preclinical animal tests, and clinical studies.
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      Product(s):
      98-53-3 4-tert-Butylcyclohexanone 99.5%
       
  • Fleurchem
    • Fleurchem, Inc.
      Have A Flavorful Day
      A leading global manufacturer and supplier of ingredients for Flavors, Fragrances, AromaTherapy, Foods, Beverages, Personal Care Products, and other uses.
      Operating out of the 200,000 sq. ft., former Hercules/PFW facility in Middletown, NY; Fleurchem produces a full range of natural isolates, synthetic chemicals & specialities, essential oils and flavors. Additionally, the company performs toll manufacturing, as well as custom chemical synthesis for a wide range of clients.
      Email: Information
      US Voice: 845-341-2100
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      Product(s):
      para-tertiary-butyl cyclohexanone (rodox)
       
  • Global Essence
    • Global Essence Inc.
      Preferred Partner
      Accommodate each customers unique needs.
      Global Essence was founded in 1993 as a two person operation servicing regional customers in the New York/ New Jersey area. In the twenty years since, it has grown into a multinational operation with offices in the US, UK, and Singapore. These offices allow Global to provide regional support to its customers worldwide. As the world continues become more connected, this approach positions Global to continue to offer the highest quality products and experience to all of its customers.
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      Irisone Crystal
       
  • Indukern F&F
  • Lluch Essence
    • Lluch Essence S.L.
      A family company dedicated to sales and distribution
      Flexibility, availability, price and quality.
      Flexibility, availability, price and quality make LLUCH ESSENCE S.L. one of Europe’s references when it comes to essential oils and aroma chemicals, and it is now well known all around the world.
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      IRISONA
       
  • M&U International
    • M&U International LLC
      Steady supply & demand
      Meeting customers increasing demands at home as well as abroad.
      M&U dedicates itself to the development and production of new products as well as continuously promoting those new products. We’ve maintained a steady supply&demand relationship with a large number of manufacturers at home and abroad. We’ve developed an extensive network and because of our relationships with these manufacturers, we’re able to provide a stable supply of great quality materials. We’re located in China’s largest communications hub, Shanghai and in the U.S. near one of the largest sea ports on the East Coast. The strategic locations of our facilities ensure convenient, prompt and secure delivery of our products to our customers.
      Email: Sales
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      Voice: +86-21-32515501 60762991 60762992
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      Product(s):
      IFF096 Butyl Cyclohexanone PT Recrys
       
  • Moellhausen
  • Penta International
    • Penta International Corporation
      Chemistry innovation
      At Penta, our products and services help businesses do business better.
      For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
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      Product(s):
      02-57800 p-tert-BUTYLCYCLOHEXANONE
       
  • SRS Aromatics
    • SRS Aromatics Ltd
      For over 25 years
      Bringing flavour and fragrance into your world.
      As suppliers / distributors of ingredients to the fragrance and flavour industries, our goal is to provide high quality materials at competitive prices with an exceptional level of service. Established in 1984, SRS Aromatics Ltd is an independent family owned business which has become very well-respected within the fragrance and flavour industry as a reliable and trustworthy partner. Over the years this has allowed the company to develop strong relationships with many global manufacturers; several of whom we represent in the UK. A core aim of our business is to work extremely closely with both our suppliers and customers to maximise service levels with minimum disruption to supply.
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      PTBCH
       
  • Synerzine
    • Synerzine, Inc.
      Innovation. Customization. Aroma Ingredients.
      Synerzine is a leading supplier of flavor and fragrance ingredients.
      Synerzine expresses what we have grown to embody as an organization - the synergy and connection between raw ingredients, science, technology, and the final product. Our experienced team is passionate about bringing our customers high-quality innovative ingredients that they can trust.
      Building upon our 44 year history, the Synerzine team provides customers around the globe with convenient access to over 1200 high-quality aroma ingredients. We actively engage with customers to add a wide array of new products and services on a regular basis. Our aim is to delight every customer with our exceptional services, large product selection, customization and the highest quality and safety standards. We provide our customers with true value designed to help them bring their products to market faster.
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      Product(s):
      W2253 p-t-Butylcyclohexanone
       
  • TCI AMERICA
    • TCI AMERICA
      Moving Your Chemistry Forward
      We continuously strive to advance our technology.
      With East & West Coast distribution centers, count on TCI to deliver products quickly and reliably. Over 30,000 Reagents available today in benchtop to bulk quantities. We also offer custom synthesis solutions. Sign up for a TCI account today for fast and free shipping!
      Tokyo Chemical Industry Co., Ltd. (TCI) is a leading worldwide manufacturer of specialty organic chemicals founded in 1946. TCI provides organic laboratory chemicals as well as pharmaceutical, cosmetic and functional materials. More than 70 years of synthesis experience and multi-purpose plants enable TCI to offer more than 30,000 products as well as custom synthesis.
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      Product(s):
      B1074 4-tert-Butylcyclohexanone >97.0%(GC)
       
  • The John D. Walsh Company
    • The John D. Walsh Company, Inc
      Suppliers Since 1942
      Supplying the fragrance and flavor industry with high quality products.
      The John D. Walsh Company, Inc. has evolved from its beginnings as an agent/broker into a distributor of essential oils, aroma chemicals, concretes and absolutes. We currently represent the following companies, as their North American distributor: Destilerias Munoz Galvez, S.A. International Flavors & Fragrances PFW Aroma Chemicals B.V. Innospec Widnes Limited Hydrodiffusion de Guatemala, S. A. DSM Nutritional Products The John D. Walsh Company, Inc. is proud to be a founding member of IFEAT, an active member of IFRA, North America, and a corporate sponsor of the WFFC.
      Email: Information
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      History
      Product(s):
      para-tert-Butyl Cyclohexanone
       
  • The Lermond Company
    • The Lermond Company
      Your Sourcing Resource
      The Lermond family has been sourcing raw materials for the flavor and fragrance industry for nearly 7 decades.
      The Lermond Company is a women-owned distributor of raw materials primarily servicing the flavor and fragrance industry. For three generations, members of the Lermond family have been integral sourcing partners for the North American flavor and fragrance industry. We supply high quality essential oils, aroma chemicals, absolutes, concretes, resinoids and floral waters from around the world to the global industry.
      Email: Info
      Email: Tara
      Email: Erica
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      Product(s):
      47855 PARA TERTIARY BUTYL CYCLO HEXANONE CRY
       
Synonyms   Articles   Notes   Search
Fragrance Demo Formulas
CAS Number: 98-53-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 202-678-5
FDA UNII: 4M45G11K23
Nikkaji Web: J16.217E
Beilstein Number: 0507309
MDL: MFCD00001642
XlogP3: 2.60 (est)
Molecular Weight: 154.25266000
Formula: C10 H18 O
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome, Edge or firefox)
Category: fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist: Search
Google Patents: Search
US Patents: Search
EU Patents: Search
Pubchem Patents: Search
PubMed: Search
NCBI: Search
Synonyms   Articles   Notes   Search   Top
Physical Properties:
Appearance: white crystals (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Melting Point: 44.00 to  50.00 °C. @ 760.00 mm Hg
Boiling Point: 224.00 to  225.00 °C. @ 760.00 mm Hg
Boiling Point: 113.00 to  116.00 °C. @ 20.00 mm Hg
Vapor Pressure: 0.088000 mmHg @ 25.00 °C. (est)
Flash Point: 192.00 °F. TCC ( 88.89 °C. )
logP (o/w): 2.630 (est)
Soluble in:
 alcohol
 water, slightly
 water, 239.8 mg/L @ 25 °C (est)
Insoluble in:
 water
Synonyms   Articles   Notes   Search   Top
Organoleptic Properties:
 
Odor Type: woody
 
Odor Strength: high ,
recommend smelling in a 1.00 % solution or less
 
Substantivity: 16 hour(s) at 20.00 % in dipropylene glycol
 
 woody  minty  patchouli  musk  leathery  
Odor Description:
at 1.00 % in dipropylene glycol. 
woody mint patchouli musk leather
Luebke, William tgsc, (1989)
 
Odor and/or flavor descriptions from others (if found).
 
Moellhausen
PATCHOULY KETONE
Odor Description: woody, minty character, suggestive of patchouli alcohol
Taste Description: dry, camphoraceous, somewhat minty and patchouli-like
 
Synarome
IRISONE crystallised
Odor Description: strong woody note with camphorerous top note effect enhanced by powdery orris and spicy facets
 
 
Synonyms   Articles   Notes   Search   Top
Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
Synonyms   Articles   Notes   Search   Top
Suppliers:
Augustus Oils
Para Tert Butylcyclohexanone
Services
Berjé
P.T.B.C. Hexanone
Media
BOC Sciences
For experimental / research use only.
4-tert-Butylcyclohexanone 99.5%
EMD Millipore
For experimental / research use only.
4-tert-Butylcyclohexanone
Ernesto Ventós
IRISONE
Odor: IRIS,WOODY,CAMPHOR,MINTY,PUNGENT
Fleurchem
para-tertiary-butyl cyclohexanone (rodox)
Frinton Laboratories
For experimental / research use only.
p-tert-Butylcyclohexanone
Global Essence
Irisone Crystal
Indukern F&F
IRISONE (PTBCH KETONE)
Odor: WOODY, ORRIS, CAMPHORATED, MENTHOLATED
Lluch Essence
IRISONA
M&U International
Butyl Cyclohexanone PT Recrys
Moellhausen
PATCHOULY KETONE
Odor: woody, minty character, suggestive of patchouli alcohol
Flavor: dry, camphoraceous, somewhat minty and patchouli-like
Penta International
p-tert-BUTYLCYCLOHEXANONE
Santa Cruz Biotechnology
For experimental / research use only.
4-tert-Butylcyclohexanone
Seqens
Irisone Cryst., Kosher
SRS Aromatics
PTBCH
Synarome
IRISONE crystallised
Odor: strong woody note with camphorerous top note effect enhanced by powdery orris and spicy facets
Synerzine
p-t-Butylcyclohexanone
TCI AMERICA
For experimental / research use only.
4-tert-Butylcyclohexanone >97.0%(GC)
The John D. Walsh Company
para-tert-Butyl Cyclohexanone
The Lermond Company
PARA TERTIARY BUTYL CYCLO HEXANONE CRY
Synonyms   Articles   Notes   Search   Top
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LD50  5000 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 729, 1975.

Dermal Toxicity:
skin-rabbit LD50 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 729, 1975.

Inhalation Toxicity:
Not determined
Synonyms   Articles   Notes   Search   Top
Safety in Use Information:
Category: fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for para-tert-butyl cyclohexanone usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Recommendation for para-tert-butyl cyclohexanone flavor usage levels up to:
 not for flavor use.
Synonyms   Articles   Notes   Search   Top
Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 98-53-3
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 7392
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 2
 4-tert-butylcyclohexan-1-one
Chemidplus: 0000098533
RTECS: GW1140000 for cas# 98-53-3
Synonyms   Articles   Notes   Search   Top
References:
 4-tert-butylcyclohexan-1-one
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 98-53-3
Pubchem (cid): 7392
Pubchem (sid): 134971303
Synonyms   Articles   Notes   Search   Top
Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
CHEMBL: View
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2914.29.5000
ChemSpider: View
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
amber
 ambroxideFL/FR
 cistus ladaniferus resinoidFL/FR
 labdanum absoluteFL/FR
 labdanum oilFL/FR
balsamic
isobornyl formateFL/FR
 opoponax absolute (commiphora erythraea var. glabrescens engle)FL/FR
 opoponax resinoid (commiphora erythraea var. glabrescens engle)FR
camphoreous
 herbal ethanoneFR
coconut
3-butyl bicyclo[3.2.1]octan-2-oneFR
herbal
1-allyl-2,2,7,7-tetramethyl cycloheptanolFR
2-cyclohexyl cyclohexanoneFR
isodihydrolavandulolFR
(Z)-isodihydrolavandulyl acetateFR
 dimethyl cyclormol (IFF)FR
 niaouli oilFR
 pine hexanolFR
common tansy flower oilFR
common tansy flower oil dutchFR
minty
trans-para-menthan-2-oneFL/FR
2,4,4,6-tetramethyl cyclohexa-2,5-diene-1-oneFR
musk
 ethylene brassylateFL/FR
 musk decanolideFR
 musk indanoneFR
spicy
 clove stem oilFL/FR
terpenic
 frankincense oilFL/FR
thujonic
common tansy oil canadaFR
woody
 amber dodecaneFR
 amber pentadecaneFR
atlas cedarwood absoluteFR
atlas cedarwood oilFR
alpha-cedrene epoxideFR
 frankincense resinoidFL/FR
 herbal norbornaneFR
 methyl cedryl ketoneFL/FR
delta-methyl iononeFL/FR
 patchouli ethanolFR
 patchouli hexanolFR
 patchouli oil chinaFL/FR
 pinacolFR
cis-2-pinanolFR
 sandal butenolFR
 sandal pentenolFL/FR
 verdoxanFR
 woody dodecaneFR
 woody epoxideFR
 woody etherFR
 
For Flavor
 
No flavor group found for these
 ambroxideFL/FR
 cistus ladaniferus resinoidFL/FR
delta-methyl iononeFL/FR
 sandal pentenolFL/FR
amber
 labdanum absoluteFL/FR
 labdanum oilFL/FR
balsamic
 opoponax absolute (commiphora erythraea var. glabrescens engle)FL/FR
minty
trans-para-menthan-2-oneFL/FR
musk
 ethylene brassylateFL/FR
spicy
 clove stem oilFL/FR
woody
isobornyl formateFL/FR
 frankincense oilFL/FR
 frankincense resinoidFL/FR
 methyl cedryl ketoneFL/FR
 patchouli oil chinaFL/FR
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 balsamFR
 cedarFR
 herbalFR
 muskFR
 patchouliFR
 pineFR
 woodyFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
4-tert-butyl cyclohexan-1-one
4-tert-butyl cyclohexanone
para-tertiary-butyl cyclohexanone (rodox)
P-tert-butyl-cyclohexanon
4-tert-butyl-cyclohexanone
4-(tert-butyl)cyclohexan-1-one
4-(tert-butyl)cyclohexanone
4-tert-butylcyclohexan-1-one
4-tert-butylcyclohexanone
p-t-butylcyclohexanone
p-tert-butylcyclohexanone
para-tert-butylcyclohexanone
 cyclohexanone, 4- (1, 1-dimethylethyl)-
 cyclohexanone, 4-(1,1-dimethylethyl)-
 cyclohexanone, 4-tert-butyl-
4-(1,1-dimethyl ethyl) cyclohexanone
4-(1,1-dimethylethyl)cyclohexanone
 irisone crystallised (Synarome)
 P.T.B.C. hexanone
 patchouli ketone
 patchouly ketone
 phenol, 4- (1, 1-dimethylethyl)-
 PTBP
 rodox
 ucar butylphenol 4-T
Synonyms   Articles   Notes   Search   Top
Articles:
PubMed: Palladium-catalyzed decarboxylative allylic alkylation of diastereomeric β-ketoesters.
PubMed: Optimisation of a lithium magnesiate for use in the non-cryogenic asymmetric deprotonation of prochiral ketones.
PubMed: On the synergistic catalytic properties of bimetallic mesoporous materials containing aluminum and zirconium: the Prins cyclisation of citronellal.
PubMed: Asymmetric solid-phase alkylation of ketones immobilized via SAMP hydrazone analogue linkers.
PubMed: Samarium Ion-Promoted Cross-Aldol Reactions and Tandem Aldol/Evans-Tishchenko Reactions.
PubMed: Parabolic Relationship between the Basicity of the Nucleophile and pi-Face Selection in Addition of the Substituted Acetylide Ions to Cyclohexanone and Cyclohexanethione.
PubMed: Cyclic Hydroborate Complexes of Metallocenes II: Reactivity of (&mgr;-H)(2)(BC(5)H(10))(2) and Its Cyclic Derivative, [H(2)BC(5)H(10)](-); Synthesis of (eta(5)-C(5)H(5))(2)MCl(&mgr;-H)(2)BC(5)H(10) (M = Zr, Hf).
PubMed: [Development of highly stereoselective reactions utilizing heteroatoms--new approach to the stereoselective Horner-Wadsworth-Emmons reaction].
PubMed: Stereoselective reactions. XXXII. Enantioselective deprotonation of 4-tert-butylcyclohexanone by fluorine-containing chiral lithium amides derived from 1-phenylethylamine and 1-(1-naphthyl)ethylamine.
PubMed: Convulsant and anticonvulsant cyclopentanones and cyclohexanones.
PubMed: Effect of cyclohexanone derivatives on percutaneous absorption of ketoprofen and indomethacin.
PubMed: The metabolism of the isomeric tert.-butylcyclohexanones.
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