EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

patchouli ethanol
patchomint (IFF)

Supplier Sponsors

Name:2-(6,6-dimethyl-5-bicyclo[2.2.1]heptanylidene)ethanol
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
 
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
 
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 sample from: International Flavors & Fragrances Inc.
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
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
 
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
 
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.
 
Safety References:
EPI System: View
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
 
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
 
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
 
Potential Blenders and core components note
For Odor
balsamic
dextro,laevo-
borneol
FL/FR
laevo-
borneol
FL/FR
iso
bornyl formate
FL/FR
iso
bornyl methyl ether
FL/FR
iso
bornyl propionate
FL/FR
camphoreous
thujyl alcohol
FL/FR
citrus
ocimene quintoxide
FL/FR
herbal
1-
allyl-2,2,7,7-tetramethyl cycloheptanol
FR
barosma betulina leaf oil
FL/FR
camphene carbinol
FR
camphene carbinyl acetate
FR
1,4-
cineole
FL/FR
dimethyl cyclormol (IFF)
FR
geranic oxide
FL/FR
herbal dioxane
FR
herbal undecanol
FR
lavandin concrete
FL/FR
methyl cyclogeranate (Firmenich)
FR
origanum oil
FL/FR
origanum oil greece
FL/FR
pine hexanol
FR
pinocarveol
FL/FR
piperitone
FL/FR
rosemary absolute
FL/FR
rosemary oil morocco
FL/FR
rosemary oil spain
FL/FR
mentholic
peppermint cyclohexanone
FL/FR
spicy
carvacrol
FL/FR
white
sassafras oil
FL/FR
laevo-
verbenone
FL/FR
thujonic
armoise oil
FR
cedarleaf oil terpeneless
FR
woody
bornyl valerate
FL/FR
para-tert-
butyl cyclohexanone
FR
2-tert-
butyl cyclohexanone
FR
alpha-
cedrene epoxide
FR
herbal norbornane
FR
hinoki root oil
FR
iso
longifolene ketone
FR
delta-
methyl ionone
FL/FR
patchouli hexanol
FR
patchouli oil china
FL/FR
patchouli woody amber fragrance
FR
pinacol
FR
lariciu
pine needle oil
FR
sandalwood specialty
FR
timber propanol
FR
3(or 2),4,5-
trimethyl octahydro-4,7-methanoinden-5-ol
FR
woody dodecane
FR
woody epoxide
FR
woody ether
FR
For Flavor
No flavor group found for these
dextro,laevo-
borneol
FL/FR
iso
bornyl methyl ether
FL/FR
delta-
methyl ionone
FL/FR
white
sassafras oil
FL/FR
laevo-
verbenone
FL/FR
thujyl alcohol
FL/FR
balsamic
balsamic
iso
bornyl propionate
FL/FR
camphoreous
laevo-
borneol
FL/FR
geranic oxide
FL/FR
pinocarveol
FL/FR
cooling
1,4-
cineole
FL/FR
green
ocimene quintoxide
FL/FR
herbal
barosma betulina leaf oil
FL/FR
lavandin concrete
FL/FR
origanum oil
FL/FR
origanum oil greece
FL/FR
rosemary absolute
FL/FR
rosemary oil morocco
FL/FR
rosemary oil spain
FL/FR
mentholic
peppermint cyclohexanone
FL/FR
minty
piperitone
FL/FR
spicy
carvacrol
FL/FR
woody
iso
bornyl formate
FL/FR
bornyl valerate
FL/FR
patchouli oil china
FL/FR
 
Potential Uses:
FRacacia
FRamber
FRambergris
FRambreine
FRamyris
FL/FRangelica
FRash mountain ash
FRbark
FRbayberry
FL/FRbeech
FL/FRbenzoin absolute replacer
FRbergamot
FL/FRbirch tar
FRbois de rose
FRboronia
FRboxwood
FLbuchu leaf
FRcabreuva wood
FRcade oil replacer
FRcalamus oil replacer
FRcardamom oil replacer
FRcedar
FRcedar forest
FRcedarwood
FRcedarwood atlas
FRcelery
FRcigar
FL/FRcistus
FRcitronella
FRclary sage oil replacer
FRcostus
FL/FRcroton eluteria bark
FRcypress oil replacer
FRdogwood
FRelemi
FRfern
FRfir needle oil replacer
FRforest
FRfrankincense
FL/FRgalangal root
FRgalbanum
FRginger
FRgingergrass
FL/FRguaiacwood
FRgurjun balsam
FRhay new mown hay
FRheather
FRherbal
FRhinoki oil replacer
FL/FRhyssop
FRiris blossom
FRjuniper
FRjuniper berry
FRlabdanum
FRmace
FRmaja
FRmimosa
FRmint
FRoakwood
FRopoponax
FL/FRorange bitter orange peel
FRoregano
FRoriental
FRorris
FRosmanthus
FRpatchouli
FRpine forest
FL/FRpine needle
FL/FRpine scotch pine
FRpinion
FRredwood
FRsandalwood
FRspice
FRspikenard oil replacer
FRspruce
FRsweet grass
FL/FRtansy oil replacer
FL/FRtarragon oil replacer
FLtea black tea
 timber
FRtolu balsam
FL/FRvalerian
FRvetiver
FRwoody
FRwormseed oil replacer
 
Occurrence (nature, food, other):note
 not found in nature
 
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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