3-hexanol
ethyl propyl carbinol
 
Notes:
3-Hexanol occurs naturally in the flavor and aroma of plants such as pineapple and is used as a food additive to add flavor. (Wikipedia)
  • Alfrebro
    • Alfrebro LLC/ Archer Daniels Midland Company
      Let's get reacquainted
      Building great taste with aroma chemicals, extracts, and distillates
      The Alfrebro brand was established in the early 1900s by Alex Fries & Brothers, a Cincinnati Flavor Company. In 1980, the brand was re-launched as an aroma chemical manufacturer. Since its inception, Alfrebro’s primary focus has been to provide quality natural and high value synthetic chemicals.
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  • Beijing Lys Chemicals
    • Beijing Lys Chemicals Co, LTD.
      From Grams to Tons
      Fine chemical high-tech company which contains R&D, production, and sales.
      BEIJING LYS CHEMICALS CO, LTD, established in 2004, is a fine chemical high-tech company which contains R&D, production, and sales. We mainly engaged in export and technology development of flavor and fragrance materials and pharmaceutical intermediates. We have nearly 500 kinds of products, from grams to tons, exported to USA, Europe, South Asia and etc. And we custom manufacture new products according to customers’ needs, and serve good quality products and service. Our goal is to become a fine chemical enterprise which could provide special products and services.
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      Product(s):
      10155 3-Hexanol
       
  • CJ Latta & Associates
    • CJ Latta & Associates, LLC
      Extensive Line
      Aromatic Chemicals and Organic Acids.
      CJ Latta & Associates is a distributor of specialty aromatics and organic acids used in the formulation of flavors and fragrance manufactured worldwide. We pride ourselves on our reputation for, fair pricing, quality and reliability. We’ve built our business on successfully sourcing and developing many challenging specialty chemicals and fine ingredients for our clients.
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      3-HEXANOL
       
  • Glentham Life Sciences
  • 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.
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      A0314 3-HEXANOL, Kosher
       
  • 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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      08-25000 3-HEXANOL
       
  • Sigma-Aldrich
  • 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):
      W01716 3-Hexanol
       
  • 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):
      H0132 3-Hexanol >98.0%(GC)
       
  • WholeChem
    • WholeChem, LLC
      Connecting Innovators To the Building Blocks Of the Universe
      Custom manufacturer and distributor of specialty ingredients. We make global local.
      SQF-Certified Supplier
      We owe our success to our integrity, our dedication to the industry, and our commitment to our clients. We invite your inquiries regarding our current product list and any other products you may be having trouble sourcing.
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      Product(s):
      3-Hexanol
       
Synonyms   Articles   Notes   Search
CAS Number: 623-37-0Picture of molecule3D/inchi
Other(deleted CASRN): 17015-11-1
ECHA EINECS - REACH Pre-Reg: 210-790-0
FDA UNII: I1ZTO95J84
Nikkaji Web: J94.874H
Beilstein Number: 1718964
MDL: MFCD00004582
CoE Number: 11775
XlogP3: 1.70 (est)
Molecular Weight: 102.17678000
Formula: C6 H14 O
NMR Predictor: Predict (works with chrome or firefox)
EFSA/JECFA Comments: JECFA evaluated 3-hexanol (CASrn as in Register). (R)- or (S)- enantiomer not specified by CASrn in Register.
Category: flavor and 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
JECFA Food Flavoring: 282  3-hexanol
DG SANTE Food Flavourings: 02.089  hexan-3-ol
FEMA Number: 3351 3-hexanol
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):623-37-0 ; 3-HEXANOL
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.81800 to 0.82200 @  20.00 °C.
Pounds per Gallon - (est).: 6.815 to  6.848
Refractive Index: 1.41400 to 1.41800 @  20.00 °C.
Boiling Point: 133.00 to  135.00 °C. @ 760.00 mm Hg
Vapor Pressure: 3.393000 mmHg @ 25.00 °C. (est)
Flash Point: 107.00 °F. TCC ( 41.67 °C. )
logP (o/w): 1.650
Soluble in:
 alcohol
 water, 1.453e+004 mg/L @ 25 °C (est)
 water, 1.61E+04 mg/L @ 25 °C (exp)
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Organoleptic Properties:
 
Odor Type: alcoholic
 
 alcoholic  medicinal  ethereal  
Odor Description:
at 1.00 % in dipropylene glycol. 
alcoholic medicinal ethereal
 
 fusel  green  solvent  alcoholic  fruit tropical fruit  pineapple  apple  cider  rummy  
Odor Description:
at 1.00 %.  
fusel, green, solventy alcoholic, with nuances of tropical fruits, pineapple, apple and cider and rum
Mosciano, Gerard, (2009)
 
 
Flavor Type: alcoholic
 
 alcoholic  solvent  fusel  rummy  egg nog  whiskey  green  fruity  guava  apple  
Taste Description:
at 20.00 ppm.  
alcoholic solvent like, fusel notes of rum, egg nogg and whiskey, green fruity nuances of guava and apple
Mosciano, Gerard, (2009)
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
Synonyms   Articles   Notes   Search   Top
Suppliers:
Alfrebro
3-HEXANOL NATURAL
Odor: Alcoholic, Ethereal, Medicinal
Beijing Lys Chemicals
3-Hexanol
CJ Latta & Associates
3-HEXANOL
DeLong Chemicals America
3-Hexanol
Glentham Life Sciences
3-Hexanol
M&U International
3-HEXANOL, Kosher
Nagar Haveli Perfumes & Aromatics
3 - Hexanol
Odor: fusel, green, solventy alcoholic, with nuances of tropical fruits, pineapple, apple and cider and rum
Penta International
3-HEXANOL
Reincke & Fichtner
3-Hexanol
Santa Cruz Biotechnology
For experimental / research use only.
3-Hexanol
Sigma-Aldrich
3-Hexanol, ≥97%
Odor: alcohol; medicinal; ethereal
Certified Food Grade Products
Synerzine
3-Hexanol
TCI AMERICA
For experimental / research use only.
3-Hexanol >98.0%(GC)
WholeChem
3-Hexanol
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Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 10 - Flammable.
R 36 - Irritating to eyes.
S 02 - Keep out of the reach of children.
S 16 - Keep away from sources of ignition - No Smoking.
S 24/25 - Avoid contact with skin and eyes.
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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: flavor and 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 3-hexanol usage levels up to:
  0.6000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 11.00 (μg/capita/day)
Structure Class: II
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 6
Click here to view publication 6
 average usual ppmaverage maximum ppm
baked goods: -2.00000
beverages(nonalcoholic): -1.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -1.00000
fruit ices: -1.00000
gelatins / puddings: -1.00000
granulated sugar: --
gravies: --
hard candy: -2.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: -1.00000
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
Synonyms   Articles   Notes   Search   Top
Safety References:
European Food Safety Athority(EFSA): Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
European Food Safety Authority (EFSA) reference(s):
Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 7 (FGE.07): Saturated and unsaturated aliphatic secondary alcohols, ketones and esters of secondary alcohols and saturated linear or branched-chain carboxylic acids from chemical group 5
View page or View pdf
Flavouring Group Evaluation 7, Revision 1 (FGE.07Rev1): Saturated and unsaturated aliphatic secondary alcohols, ketones and esters of secondary alcohols and saturated linear or branched-chain carboxylic acids from chemical group 5 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Scientific opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission
View page or View pdf
Flavouring Group Evaluation 7, Revision 2 (FGE.07Rev2) : Saturated and unsaturated aliphatic secondary alcohols, ketones and esters of secondary alcohols and saturated linear or branched-chain carboxylic acids from chemical group 5
View page or View pdf
Safety and efficacy of saturated and unsaturated aliphatic secondary alcohols, ketones and esters with esters containing secondary alcohols belonging to chemical group 5 when used as flavourings for all animal species
View page or View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 623-37-0
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 12178
National Institute of Allergy and Infectious Diseases: Data
WISER: UN 2282
WGK Germany: 1
 hexan-3-ol
Chemidplus: 0000623370
RTECS: MIO857000 for cas# 623-37-0
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References:
 hexan-3-ol
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 623-37-0
Pubchem (cid): 12178
Pubchem (sid): 134976948
Pherobase: View
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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
FDA Substances Added to Food (formerly EAFUS): View
CHEMBL: View
HMDB (The Human Metabolome Database): HMDB31493
FooDB: FDB008073
Export Tariff Code: 2905.19.9090
Typical G.C.
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
amber
amber
 acetoxymethyl isolongifoleneFR
 formoxymethyl isolongifoleneFR
 hydroxymethyl isolongifolene 50% in dpgFR
balsamic
 sclareolFL/FR
cocoa
2-methyl butyraldehydeFL/FR
floral
 petitgrain oil paraguayFL/FR
fruity
 ethyl isobutyrateFL/FR
green
 magnolia flower oilFL/FR
herbal
 bergamot mint herb oilFR
 clary acetateFR
 clary propyl acetateFR
 clary sage resin americaFR
 costmary oil (chrysanthemum balsamita)FR
 herbal careneFR
 ocimene oxiraneFR
woody
 sclarene 
 
For Flavor
 
No flavor group found for these
 ethanolFL
 magnolia flower oilFL/FR
 sclarene 
ethereal
 ethyl isobutyrateFL/FR
fusel
2-methyl butyraldehydeFL/FR
 petitgrain oil paraguayFL/FR
woody
 sclareolFL/FR
 
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Potential Uses:
 floralFR
 fruit tropical fruitFL
 herbalFR
 hyacinthFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 apricot fruit
Search Trop  Picture
 banana fruit
Search Trop  Picture
 cheese parmesan cheese
Search  PMC Picture
 chicken cooked chicken
Search  PMC Picture
 clary sage oil greece @ 0.15%
Data  GC  Search Trop  Picture
 cognac
Search  PMC Picture
 cranberry fruit
Search Trop  Picture
 currant black currant fruit
Search Trop  Picture
 grapefruit juice
Search Trop  Picture
 papaya fruit
Search Trop  Picture
 pepper bell pepper fruit
Search Trop  Picture
 pineapple fruit
Search Trop  Picture
 safflower flower
Search Trop  Picture
Synonyms   Articles   Notes   Search   Top
Synonyms:
 ethyl N-propyl carbinol
 ethyl propyl carbinol
 hexan-3-ol
3-hexyl alcohol
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Articles:
PubMed: Copper-organic frameworks assembled from in situ generated 5-(4-pyridyl)tetrazole building blocks: synthesis, structural features, topological analysis and catalytic oxidation of alcohols.
PubMed: Synthetic cis-jasmone exposure induces wheat and barley volatiles that repel the pest cereal leaf beetle, Oulema melanopus L.
PubMed: New active HIV-1 protease inhibitors derived from 3-hexanol: conformation study of the free inhibitors in crystalline state and in complex with the enzyme.
PubMed: Selective hydroxylation of alkanes by an extracellular fungal peroxygenase.
PubMed: Inhibition of MMPs by alcohols.
PubMed: Synthesis of conformationally locked L-deoxythreosyl phosphonate nucleosides built on a bicyclo[3.1.0]hexane template.
PubMed: Dependence of the enantioselectivity on reversion of layer directions in cholamide inclusion compounds.
PubMed: [Identification of volatiles from field cotton plant under different induction treatments].
PubMed: Purification and characterization of alcohol dehydrogenase reducing N-benzyl-3-pyrrolidinone from Geotrichum capitatum.
PubMed: Reliability of fibres in solid-phase microextraction for routine analysis of the headspace of aromatic and medicinal plants.
PubMed: Solid-phase microextraction: investigation of the metabolism of substances that may be abused by inhalation.
PubMed: Impact of phase ratio, polydimethylsiloxane volume and size, and sampling temperature and time on headspace sorptive extraction recovery of some volatile compounds in the essential oil field.
PubMed: Synthesis and biological activity of the four stereoisomers of 4-methyl-3-heptanol: main component of the aggregation pheromone of Scolytus amygdali.
PubMed: Pharmaco attributes of dioleoylphosphatidylethanolamine/cholesterylhemisuccinate liposomes containing different types of cleavable lipopolymers.
PubMed: Substrate entropy in enzyme enantioselectivity: an experimental and molecular modeling study of a lipase.
PubMed: A comparison of lipase-catalysed ester and lactone synthesis in low-water systems: analysis of optimum water activity.
PubMed: Functional Cyp2e1 is required for substantial in vivo formation of 2,5-hexanedione from n-hexane in the mouse.
PubMed: An investigation into the role of rat skeletal muscle as a site for xenobiotic metabolism using microsomes and isolated cells.
PubMed: Metabolism of n-hexane by rat liver and extrahepatic tissues and the effect of cytochrome P-450 inducers.
PubMed: Alkoxy Radical Isomerization Products from the Gas-Phase OH Radical-Initiated Reactions of 2,4-Dimethyl-2-pentanol and 3,5-Dimethyl-3-hexanol.
PubMed: Crystallization and preliminary X-ray study of Agkistrodon halys blomhoffii phospholipase A2 complexed with a specific inhibitor.
PubMed: Synthesis, configuration, and evaluation of two conformationally restrained analogues of phencyclidine.
PubMed: The relevance of 4,5-dihydroxy-2-hexanone in the excretion kinetics of n-hexane metabolites in rat and man.
PubMed: Rat lung and liver microsomal cytochrome P-450 isozymes involved in the hydroxylation of n-hexane.
PubMed: Methodological investigations on the determination of n-hexane metabolites in urine.
PubMed: Analysis of n-hexane, 2-hexanone, 2,5-hexanedione, and related chemicals by capillary gas chromatography and high-performance liquid chromatography.
PubMed: Selective inhibition by chloramphenicol of cytochrome P-450 isozymes in rat lung and liver involved in the hydroxylation of n-hexane.
PubMed: Position specificity in n-hexane hydroxylation by two forms of cytochrome P-450 in rat liver microsomes.
PubMed: Urinary excretion of n-hexane metabolites. A comparative study in rat, rabbit and monkey.
PubMed: Phthalate esters I: Effects on cytochrome P-450 mediated metabolism in rat liver and lung, serum enzymatic activities and serum protein levels.
PubMed: Experimental neurotoxicity and urinary metabolites of the C5-C7 aliphatic hydrocarbons used as glue solvents in shoe manufacture.
PubMed: Regio-selectivity of purified forms of rabbit liver microsomal cytochrome P-450 in the metabolism of benzo(a)pyrene, n-hexane and 7-ethoxyresorufin.
PubMed: Regulation of primary alkylsulfatase induction in Pseudomonas C12B: concentration-dependent stimulation-inhibition by exogenous UTP and sodium acetate and inhibition by 1-hexanol.
PubMed: The specificities and configurations of ternary complexes of yeast and liver alcohol dehydrogenases.
PubMed: The estimation of darstine, 1-(3-hydroxy-5-methyl-4-phenylhexyl)-1-methylpiper idinium bromide and its tertiary analog, 5-methyl-4-phenyl-1-(1-piperidyl)-3-hexanol hydrochloride, in plasma and urine.
PubMed: Physiological economy of darstine, 5-methyl-4-phenyl-1-(piperidyl)-3-hexanol methobromide, visceral anticholinergic agent.
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