patchouli ethanol
patchomint (IFF)
 
Notes:
None found
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      2226-05-3 delta-2, β-norBornane Ethanol, 3,3-dimethyl
       
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CAS Number: 2226-05-3Picture of molecule3D/inchi
Other(deleted CASRN): 22485-72-9
ECHA EINECS - REACH Pre-Reg: 218-755-1
MDL: MFCD00154024
XlogP3-AA: 2.30 (est)
Molecular Weight: 166.26366000
Formula: C11 H18 O
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
Also(can) Contains: (Z)-patchouli ethanol
 (E)-patchouli ethanol
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
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Physical Properties:
Appearance: colorless clear slightly viscous liquid (est)
Assay: 75.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.98100 to 0.98800 @  25.00 °C.
Pounds per Gallon - (est).: 8.163 to  8.221
Specific Gravity: 0.98200 to 0.98900 @  20.00 °C.
Pounds per Gallon - est.: 8.181 to 8.239
Refractive Index: 1.50100 to 1.50500 @  20.00 °C.
Boiling Point: 241.00 to  242.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.006000 mmHg @ 25.00 °C. (est)
Flash Point: > 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 3.220 (est)
Soluble in:
 alcohol
 water, 318.1 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: woody
 
Odor Strength: medium
 
Substantivity: 156 hour(s) at 100.00 %
 
 dry  sawdust  woody  patchouli  camphoreous  minty  
Odor Description:
at 100.00 %. 
dry sawdust woody patchouli camphor mint
Luebke, William tgsc, (1990)
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
BOC Sciences
For experimental / research use only.
delta-2, β-norBornane Ethanol, 3,3-dimethyl
Sigma-Aldrich: Aldrich
For experimental / research use only.
DL-Patchenol
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Safety Information:
Preferred SDS: View
 
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: fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for patchouli ethanol usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Recommendation for patchouli ethanol flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 2226-05-3
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 94046
National Institute of Allergy and Infectious Diseases: Data
 2-(6,6-dimethyl-5-bicyclo[2.2.1]heptanylidene)ethanol
Chemidplus: 0002226053
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References:
 2-(6,6-dimethyl-5-bicyclo[2.2.1]heptanylidene)ethanol
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 2226-05-3
Pubchem (cid): 94046
Pubchem (sid): 135054162
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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
HMDB (The Human Metabolome Database): Search
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
balsamic
dextro,laevo-borneolFL/FR
laevo-borneolFL/FR
isobornyl formateFL/FR
isobornyl methyl etherFL/FR
isobornyl propionateFL/FR
camphoreous
 thujyl alcoholFL/FR
citrus
 ocimene quintoxideFL/FR
herbal
1-allyl-2,2,7,7-tetramethyl cycloheptanolFR
 barosma betulina leaf oilFL/FR
 camphene carbinolFR
 camphene carbinyl acetateFR
1,4-cineoleFL/FR
 dimethyl cyclormol (IFF)FR
 geranic oxideFL/FR
 herbal dioxaneFR
 herbal undecanolFR
 lavandin concreteFL/FR
 methyl cyclogeranate (Firmenich)FR
 origanum oilFL/FR
 origanum oil greeceFL/FR
 pine hexanolFR
 pinocarveolFL/FR
 piperitoneFL/FR
 rosemary absoluteFL/FR
 rosemary oil moroccoFL/FR
 rosemary oil spainFL/FR
mentholic
 peppermint cyclohexanoneFL/FR
spicy
 carvacrolFL/FR
white sassafras oilFL/FR
laevo-verbenoneFL/FR
thujonic
 armoise oilFR
 cedarleaf oil terpenelessFR
woody
 bornyl valerateFL/FR
para-tert-butyl cyclohexanoneFR
2-tert-butyl cyclohexanoneFR
alpha-cedrene epoxideFR
 herbal norbornaneFR
 hinoki root oilFR
isolongifolene ketoneFR
delta-methyl iononeFL/FR
 patchouli hexanolFR
 patchouli oil chinaFL/FR
 patchouli woody amber fragranceFR
 pinacolFR
lariciu pine needle oilFR
 sandalwood specialtyFR
 timber propanolFR
3(or 2),4,5-trimethyl octahydro-4,7-methanoinden-5-olFR
 woody dodecaneFR
 woody epoxideFR
 woody etherFR
 
For Flavor
 
No flavor group found for these
dextro,laevo-borneolFL/FR
isobornyl methyl etherFL/FR
delta-methyl iononeFL/FR
white sassafras oilFL/FR
laevo-verbenoneFL/FR
 thujyl alcoholFL/FR
balsamic
isobornyl propionateFL/FR
camphoreous
laevo-borneolFL/FR
 geranic oxideFL/FR
 pinocarveolFL/FR
cooling
1,4-cineoleFL/FR
green
 ocimene quintoxideFL/FR
herbal
 barosma betulina leaf oilFL/FR
 lavandin concreteFL/FR
 origanum oilFL/FR
 origanum oil greeceFL/FR
 rosemary absoluteFL/FR
 rosemary oil moroccoFL/FR
 rosemary oil spainFL/FR
mentholic
 peppermint cyclohexanoneFL/FR
minty
 piperitoneFL/FR
spicy
 carvacrolFL/FR
woody
isobornyl formateFL/FR
 bornyl valerateFL/FR
 patchouli oil chinaFL/FR
 
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Potential Uses:
 acaciaFR
 amberFR
 ambergrisFR
 ambreineFR
 amyrisFR
 angelicaFL/FR
 ash mountain ashFR
 barkFR
 bayberryFR
 beechFL/FR
 benzoin absolute replacerFL/FR
 bergamotFR
 birch tarFL/FR
 bois de roseFR
 boroniaFR
 boxwoodFR
 buchu leafFL
 cabreuva woodFR
 cade oil replacerFR
 calamus oil replacerFR
 cardamom oil replacerFR
 cedarFR
 cedar forestFR
 cedarwoodFR
 cedarwood atlasFR
 celeryFR
 cigarFR
 cistusFL/FR
 citronellaFR
 clary sage oil replacerFR
 costusFR
 croton eluteria barkFL/FR
 cypress oil replacerFR
 dogwoodFR
 elemiFR
 fernFR
 fir needle oil replacerFR
 forestFR
 frankincenseFR
 galangal rootFL/FR
 galbanumFR
 gingerFR
 gingergrassFR
 guaiacwoodFL/FR
 gurjun balsamFR
 hay new mown hayFR
 heatherFR
 herbalFR
 hinoki oil replacerFR
 hyssopFL/FR
 iris blossomFR
 juniperFR
 juniper berryFR
 labdanumFR
 maceFR
 majaFR
 mimosaFR
 mintFR
 oakwoodFR
 opoponaxFR
 orange bitter orange peelFL/FR
 oreganoFR
 orientalFR
 orrisFR
 osmanthusFR
 patchouliFR
 pine forestFR
 pine needleFL/FR
 pine scotch pineFL/FR
 pinionFR
 redwoodFR
 sandalwoodFR
 spiceFR
 spikenard oil replacerFR
 spruceFR
 sweet grassFR
 tansy oil replacerFL/FR
 tarragon oil replacerFL/FR
 tea black teaFL
 timber 
 tolu balsamFR
 valerianFL/FR
 vetiverFR
 woodyFR
 wormseed oil replacerFR
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
2-(3,3-dimethyl bicyclo(2.2.1)hept-2-ylidene) ethanol
2-dimethyl bicyclohept-2-ylidene ethanol
2,2-dimethyl-1-norbornylidene ethanol
3,3-dimethyl-2-norbornane-2-ethanol
2-(6,6-dimethyl-5-bicyclo[2.2.1]heptanylidene)ethanol
3,3-dimethyl-delta-2,beta-norbornane ethanol
3,3-dimethyl-delta(2,beta)-norbornane ethanol
2-(3,3-dimethylbicyclo(2.2.1)hept-2-ylidene)ethanol
 ethanol, 2- (3, 3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
 ethanol, 2-(3,3-dimethylbicyclo(2.2.1)hept-2-ylidene)-
(±)-patchenol
 patchomint (IFF)
 patchouli ethanol
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