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

trimethyl cyclohexene
cyclohexene, 1,2,3-trimethyl-

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Name:1,2,3-trimethylcyclohexene
CAS Number: 68555-95-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:271-464-1
Nikkaji Web:J11.592D
XlogP3-AA:3.00 (est)
Molecular Weight:124.22652000
Formula:C9 H16
NMR Predictor:Predict (works with chrome 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
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity:0.78500 to 0.79500 @ 25.00 °C.
Pounds per Gallon - (est).: 6.532 to 6.615
Refractive Index:1.43000 to 1.44500 @ 20.00 °C.
Boiling Point: 32.00 °C. @ 30.00 mm Hg
Vapor Pressure:8.215000 mm/Hg @ 25.00 °C. (est)
Flash Point: 60.00 °F. TCC ( 15.56 °C. )
logP (o/w): 4.249 (est)
Soluble in:
 alcohol
 water, 5.119 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: citrus
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
Substantivity:8 hour(s) at 100.00 %
lime citrus lemon herbal terpenic
Odor Description:at 10.00 % in dipropylene glycol. lime citrus lemon herbal terpene
Luebke, William tgsc, (1989)
Odor sample from: Bedoukian Research, Inc.
Odor and/or flavor descriptions from others (if found).
Bedoukian Research
TRIMETHYL CYCLOHEXENE
Odor Description:A strong lemon-lime topnote
For use in citrus compositions requiring a lemon-lime lift.
 
Cosmetic Information:
None found
 
Suppliers:
Bedoukian Research
TRIMETHYL CYCLOHEXENE
Odor: A strong lemon-lime topnote
Use: For use in citrus compositions requiring a lemon-lime lift.
 
Safety Information:
 
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
Recommendation for trimethyl cyclohexene usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Recommendation for trimethyl cyclohexene flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):68555-95-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 1993
WGK Germany:2
1,2,3-trimethylcyclohexene
Chemidplus:0068555953
 
References:
 1,2,3-trimethylcyclohexene
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:68555-95-3
Pubchem (cas):68555-95-3
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (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
croton glabellus bark extract
FL/FR
citrus
acetaldehyde citronellyl methyl acetal
FR
aldehydic nitrile
FR
beta-
bisabolol
FL/FR
cedrat peel oil
FL/FR
citral
FL/FR
citral / methyl anthranilate schiff's base
FR
citral diethyl acetal
FL/FR
citral dimethyl acetal
FL/FR
citral propylene glycol acetal
FL/FR
citronella oil ceylon
FL/FR
citronellyl nitrile
FR
citrus ocimenol
FR
dihydromyrcenol
FL/FR
dihydromyrcenyl acetate
FR
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-yl acetate
FL/FR
dimyrcetol (IFF)
FR
homo
geranyl nitrile
FR
2-
heptanol
FL/FR
lemon hexadiene
FL/FR
lemon oil c.p. california
FL/FR
lemon oil c.p. furocoumarin reduced
FL/FR
lemon oil italy
FL/FR
lemon oil terpeneless
FL/FR
lemongrass oil
FL/FR
lemongrass oil guatemala
FL/FR
lemongrass oil morocco
FL/FR
lime octadienal
FR
lime oil distilled mexico
FL/FR
lime oil distilled peru
FL/FR
lime oil expressed florida
FL/FR
lime oil expressed terpeneless
FL/FR
lime pyran
FR
litsea cubeba fruit oil
FL/FR
litsea cubeba oil terpeneless
FL/FR
mandarin lemon fagrance
FR
neroli ketone
FR
ocimenol
FL/FR
tetrahydrocitral
FL/FR
tetrahydromyrcenol
FR
verbena oil spain
FL/FR
verbena oil terpeneless
FL/FR
floral
alpha-
amyl cinnamaldehyde dimethyl acetal
FL/FR
lemon oil distilled
FL/FR
petitgrain lemon oil
FL/FR
green
iso
decanal
FL/FR
phenyl acetaldehyde diethyl acetal
FL/FR
herbal
canarium luzonicum oil
FL/FR
dehydroxylinalool oxide
FL/FR
alpha-
dihydroterpineol
FL/FR
dihydroterpinyl acetate
FL/FR
melaleuca linariifolia oil
FR
origanum oil terpenes
FR
alpha-
terpinyl acetate
FL/FR
minty
dextro-
dihydrocarvone
FL/FR
pine
dipentene terpene hydrocarbon byproducts
FR
spicy
carrot weed oil
FL/FR
myrcene
FR
terpenic
para-
cymene
FL/FR
laevo-
limonene
FL/FR
alpha-
phellandrene
FL/FR
gamma-
terpinene
FL/FR
woody
(+)-
camphene
FL/FR
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-ol
FL/FR
sabinene
FL/FR
sandalwood oil
FL/FR
sandalwood oil CO2 extract
FL/FR
alpha-
terpinene
FL/FR
For Flavor
No flavor group found for these
alpha-
amyl cinnamaldehyde dimethyl acetal
FL/FR
(+)-
camphene
FL/FR
cedrat peel oil
FL/FR
citral propylene glycol acetal
FL/FR
croton glabellus bark extract
FL/FR
iso
decanal
FL/FR
dihydroterpinyl acetate
FL/FR
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-ol
FL/FR
(E+Z)-4,8-
dimethyl-3,7-nonadien-2-yl acetate
FL/FR
ocimenol
FL/FR
phenyl acetaldehyde diethyl acetal
FL/FR
tetrahydrocitral
FL/FR
citrus
citrus
beta-
bisabolol
FL/FR
citral
FL/FR
citral diethyl acetal
FL/FR
citral dimethyl acetal
FL/FR
citronella oil ceylon
FL/FR
lemon hexadiene
FL/FR
lemon oil c.p. california
FL/FR
lemon oil c.p. furocoumarin reduced
FL/FR
lemon oil distilled
FL/FR
lemon oil italy
FL/FR
lemon oil terpeneless
FL/FR
lemongrass oil
FL/FR
lemongrass oil guatemala
FL/FR
lemongrass oil morocco
FL/FR
lime oil distilled mexico
FL/FR
lime oil distilled peru
FL/FR
lime oil expressed florida
FL/FR
lime oil expressed terpeneless
FL/FR
litsea cubeba fruit oil
FL/FR
petitgrain lemon oil
FL/FR
verbena oil spain
FL/FR
verbena oil terpeneless
FL/FR
fruity
2-
heptanol
FL/FR
green
canarium luzonicum oil
FL/FR
carrot weed oil
FL/FR
dextro-
dihydrocarvone
FL/FR
dihydromyrcenol
FL/FR
lemon
litsea cubeba oil terpeneless
FL/FR
terpenic
para-
cymene
FL/FR
laevo-
limonene
FL/FR
alpha-
phellandrene
FL/FR
gamma-
terpinene
FL/FR
alpha-
terpinene
FL/FR
woody
dehydroxylinalool oxide
FL/FR
alpha-
dihydroterpineol
FL/FR
sabinene
FL/FR
sandalwood oil
FL/FR
sandalwood oil CO2 extract
FL/FR
alpha-
terpinyl acetate
FL/FR
 
Potential Uses:
FRcitrus
FRherbal
FRlemon
FRlime
FRorange
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 cyclohexene, 1,2,3-trimethyl-
1,5,5-trimethyl cyclohexene
1,2,3-trimethylcyclohexene
 
 
Notes:
None found
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