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

alpha-ocimene
1,3,7-octatriene, 3,7-dimethyl-, (3E)-

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Fragrance Demo Formulas
Flavor Demo Formulas
Name:(3E)-3,7-dimethylocta-1,3,7-triene
CAS Number: 502-99-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:207-957-5
FDA UNII:8DBO41SLJL
Nikkaji Web:J10.704B
XlogP3-AA:4.30 (est)
Molecular Weight:136.23752000
Formula:C10 H16
NMR Predictor:Predict (works with chrome or firefox)
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
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 169.00 to 171.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:1.971000 mm/Hg @ 25.00 °C. (est)
Flash Point: 112.00 °F. TCC ( 44.40 °C. ) (est)
logP (o/w): 4.142 (est)
Soluble in:
 alcohol
 water, 6.923 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:medium
fruity floral cloth laundered cloth
Odor Description:at 100.00 %. fruity floral wet cloth
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
3,7-Dimethylocta-1 ,3,7-triene 95%
M&U International
Ocimene(IFF# : 151353)
 
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: flavor and fragrance agents
 
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):502-99-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5320249
National Institute of Allergy and Infectious Diseases:Data
(3E)-3,7-dimethylocta-1,3,7-triene
Chemidplus:0000502998
 
References:
 (3E)-3,7-dimethylocta-1,3,7-triene
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:502-99-8
Pubchem (cid):5320249
Pubchem (sid):135059307
Flavornet:502-99-8
Pherobase:View
 
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
FooDB:FDB029667
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
For Odor
aldehydic
aldehydic specialty
FR
3-
methyl-4-hexyl oxybutyraldehyde
FR
balsamic
cinnamyl formate
FL/FR
berry
currant fragrance
FR
gooseberry fragrance
FR
huckleberry fragrance
FR
citrus
(R)-
citronellyl nitrile
FR
citronitrile (Symrise)
FR
2-
heptanol
FL/FR
fatty
butyl undecylenate
FL/FR
fermented
methyl decanoate
FL/FR
floral
acetal 318
FR
iso
amyl angelate
FL/FR
benzyl acetate
FL/FR
benzyl acetoacetate
FL/FR
benzyl isobutyrate
FL/FR
blue lagoon fragrance
FR
boronia specialty
FR
cassie specialty (acacia farnesiana)
FR
cherry blossom fragrance
FR
(S)-
citronellyl acetate
FL/FR
citronellyl butyrate
FL/FR
citronellyl hexanoate
FL/FR
(E)-
citronellyl tiglate
FL/FR
clean
cotton fragrance
FR
3-
cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl ester
FR
cymbopogon validus leaf oil
FR
gamma-
damascone
FR
dimethyl benzyl carbinyl acetate
FL/FR
3,6-
dimethyl-3-octyl acetate
FR
ethyl 2-benzyl butyrate
FL/FR
ethyl anthranilate
FL/FR
ethyl ethyl anthranilate
FL/FR
eucalyptus macarthurii oil
FR
geraniol
FL/FR
geranyl isobutyrate
FL/FR
hibiscus fragrance
FR
ionone mixed isomers
FL/FR
jasmin cyclopentanone
FR
jasmin fragrance
FR
jasmin oil CO2 extract
FL/FR
jasmin specialty
FR
iso
jasmone
FL/FR
linalyl butyrate
FL/FR
longoza absolute replacer
FR
magnolia flower oil CO2 extract
FL/FR
magnolia specialty
FR
menthadienyl formate
FR
ortho-
methoxybenzyl ethyl ether
FR
methoxymelonal
FL/FR
1-(2-
methyl allyl oxy)-3-methoxy-3-methyl-1-butane
FR
para-
methyl benzyl acetate
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
alpha-iso
methyl ionone (90% min.)
FL/FR
methyl ionyl acetate
FL/FR
(±)-3-
methyl-gamma-decalactone
FL/FR
pink
nelumbo nucifera flower absolute
FR
white
nelumbo nucifera flower absolute
FR
white
nelumbo nucifera flower concrete
FR
3-
nonanon-1-yl acetate
FL/FR
orris rhizome concrete butter (iris pallida)
FL/FR
orris rhizome concrete replacer
FR
osmanthus absolute replacer
FR
osmanthus concrete
FL/FR
petitgrain mandarin oil
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl isovalerate
FL/FR
1-
phenyl propyl butyrate
FL/FR
2-
phenyl propyl isobutyrate
FL/FR
4-
phenyl-3-buten-2-ol
FL/FR
iso
propyl benzoate
FL/FR
rhodinyl butyrate
FL/FR
rose undecene
FR
souroubea specialty
FR
star fruit oil cuba
FL/FR
stephanotis flower absolute replacer
FR
styralyl propionate
FL/FR
terpinyl valerate
FL/FR
tetrahydroionyl acetate
FR
fresh
fresh & clean fragrance
FR
fruity
allyl benzoate
FR
red
apple fragrance
FR
apricot essence
FL/FR
benzaldehyde / methyl anthranilate schiff's base
FR
benzyl propionate
FL/FR
benzyl valerate
FL/FR
berry hexanoate
FR
butyl 2-naphthyl ether
FL/FR
iso
butyl furyl propionate
FL/FR
citronellyl isobutyrate
FL/FR
beta-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
(Z)-beta-
damascone
FL/FR
decanal methyl enol ether
FL/FR
(R)-gamma-
dodecalactone
FL/FR
eriocephalus punctulatus flower oil
FR
ginsene
FR
guava fragrance
FR
linalool oxide acetates
FL/FR
melon fragrance
FR
3-
mercaptohexyl acetate
FL/FR
methyl bicycloheptenyl methyloxirane carboxylate
FR
methyl isobutyrate
FL/FR
(E)-7-
methyl-3-octen-2-one
FL/FR
myrascone
FR
2-
nonanone propylene glycol acetal
FL/FR
papaya fragrance
FR
papaya specialty
FR
peach nitrile
FR
plum damascone (high alpha)
FR
sambucus canadensis fruit absolute
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
(R)-
styralyl acetate
FL/FR
4-(para-
tolyl)-2-butanone
FL/FR
cis-
woody acetate
FR
green
iso
amyl 3-(2-furan) propionate
FL/FR
1-[(3aS,7aR)-3a,4,7,7a-
tetrahydro-1H-inden-6-yl]ethanone
FR
herbal
chamomile isobutyrate
FR
chamomile propionate
FR
geranium cyclohexane
FR
marigold absolute (tagetes patula)
FR
methyl cyclogeranate (Firmenich)
FR
iso
nonyl acetate
FR
tagete oil madagascar
FL/FR
medicinal
ortho-
cresyl acetate
FL/FR
melon
melon specialty
FR
mentholic
laevo-
menthyl acetate
FL/FR
powdery
alpha-
methyl ionone
FL/FR
(E)-alpha-
methyl ionone (74-80%)
FL/FR
spicy
crocus sativus stigma tincture
FR
honey extract
CS
spicy acetoacetate
FL/FR
tropical
triflaige A
FR
waxy
dihydrocitronellyl acetate
FL/FR
(E)-
methyl geranate
FL/FR
phytyl acetate
FL/FR
1-
undecanol
FL/FR
woody
2-
decalinyl acetate
FR
melozol acetate
FR
rhubarb oxirane
FR
For Flavor
No flavor group found for these
1-
acetyl cyclohexyl acetate
FL
iso
amyl angelate
FL/FR
benzyl valerate
FL/FR
butyl 2-naphthyl ether
FL/FR
2-
butyl thiophene
FL
ortho-
cresyl acetate
FL/FR
dihydrocitronellyl acetate
FL/FR
S-(2,5-
dimethyl-3-furyl) ethane thioate
FL
(R)-gamma-
dodecalactone
FL/FR
ethyl 2-benzyl butyrate
FL/FR
ethyl 3-hydroxyoctanoate
FL
ethyl ethyl anthranilate
FL/FR
4-
hydroxyphenethyl alcohol
FL
ionone mixed isomers
FL/FR
linalool oxide acetates
FL/FR
magnolia flower oil CO2 extract
FL/FR
methyl benzyl acetate (mixed ortho-,meta-,para-)
FL/FR
(E)-
methyl geranate
FL/FR
(±)-3-
methyl-gamma-decalactone
FL/FR
2-
nonanone propylene glycol acetal
FL/FR
1-
phenyl propyl butyrate
FL/FR
2-
phenyl propyl isobutyrate
FL/FR
phytyl acetate
FL/FR
iso
propyl benzoate
FL/FR
(R)-
styralyl acetate
FL/FR
vitispirane
FL
iso
amyl 3-(2-furan) propionate
FL/FR
benzyl acetoacetate
FL/FR
iso
butyl furyl propionate
FL/FR
beta-
damascone
FL/FR
decanal methyl enol ether
FL/FR
aldehydic
aldehydic
1-
undecanol
FL/FR
burnt
ethyl 2-furoate
FL
citrus
petitgrain mandarin oil
FL/FR
styralyl propionate
FL/FR
ethereal
methyl isobutyrate
FL/FR
fatty
methyl decanoate
FL/FR
(E)-7-
methyl-3-octen-2-one
FL/FR
floral
(S)-
citronellyl acetate
FL/FR
citronellyl hexanoate
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
geraniol
FL/FR
geranyl isobutyrate
FL/FR
jasmin oil CO2 extract
FL/FR
linalyl butyrate
FL/FR
2-
methyl butyl 3-methyl butenoate
FL
(E)-alpha-
methyl ionone (74-80%)
FL/FR
alpha-iso
methyl ionone (90% min.)
FL/FR
orris rhizome concrete butter (iris pallida)
FL/FR
rhodinyl butyrate
FL/FR
fruity
apricot essence
FL/FR
benzyl acetate
FL/FR
benzyl isobutyrate
FL/FR
benzyl propionate
FL/FR
citronellyl butyrate
FL/FR
citronellyl isobutyrate
FL/FR
(Z)-beta-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
ethyl anthranilate
FL/FR
2-
heptanol
FL/FR
2-
hexyl-4-acetoxytetrahydrofuran
FL
methoxymelonal
FL/FR
para-
methyl benzyl acetate
FL/FR
alpha-
methyl ionone
FL/FR
3-
nonanon-1-yl acetate
FL/FR
osmanthus concrete
FL/FR
phenethyl isovalerate
FL/FR
sambucus canadensis fruit absolute
FL/FR
star fruit oil cuba
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
tagete oil madagascar
FL/FR
terpinyl valerate
FL/FR
4-(para-
tolyl)-2-butanone
FL/FR
green
(E)-
citronellyl tiglate
FL/FR
iso
jasmone
FL/FR
honey
phenethyl isobutyrate
FL/FR
minty
laevo-
menthyl acetate
FL/FR
spicy
cinnamyl formate
FL/FR
spicy acetoacetate
FL/FR
tropical
3-
mercaptohexyl acetate
FL/FR
waxy
butyl undecylenate
FL/FR
4-
phenyl-3-buten-2-ol
FL/FR
woody
methyl ionyl acetate
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 calycanthus floridus
Search Trop Picture
 celery seed oil CO2 extract @ 0.02%
Data GC Search Trop Picture
 celery seed oil india @ 0.07%
Data GC Search Trop Picture
 fennel sea fennel
Search Trop Picture
 melissa oil slovak republic @ 0.26%
Data GC Search Trop Picture
 ocimum gratissimum herb oil india @ 0.28%
Data GC Search Trop Picture
 papaya fruit
Search Trop Picture
 
Synonyms:
3,7-dimethyl octa-1,3,7-triene
2,6-dimethyl-1,5,7-octatriene
(3E)-3,7-dimethylocta-1,3,7-triene
 ocimene
a-ocimene
1,3,7-octatriene, 3,7-dimethyl-, (3E)-
 

Articles:

PubMed:Characterization of aroma-active compounds in dry flower of Malva sylvestris L. by GC-MS-O analysis and OAV calculations.
PubMed:The compositions of volatiles and aroma-active compounds in dried omija fruits (Schisandra chinensis Baillon) according to the cultivation areas.
PubMed:Comparative analysis of essential oils from eight herbal medicines with pungent flavor and cool nature by GC-MS and chemometric resolution methods.
PubMed:Volatile constituents and key odorants in leaves, buds, flowers, and fruits of Laurus nobilis L.
PubMed:Characterization of the key aroma compounds in dried fruits of the West African peppertree Xylopia aethiopica (Dunal) A. Rich (Annonaceae) using aroma extract dilution analysis.
PubMed:Development and assessment of plant-based synthetic odor baits for surveillance and control of malaria vectors.
PubMed:Cashew volatiles mediate short-range location responses in Pseudotheraptus wayi (Heteroptera: Coreidae).
PubMed:Enzymatic modification of palmarosa essential oil: chemical analysis and olfactory evaluation of acylated products.
PubMed:Characterization of aroma-active compounds in dry flower of Malva sylvestris L. by GC-MS-O analysis and OAV calculations.
PubMed:Specificity and sensitivity of plant odor-detecting olfactory sensory neurons in Ctenarytaina eucalypti (Sternorrhyncha: Psyllidae).
PubMed:Antioxidant and antibacterial effects of Lavandula and Mentha essential oils in minced beef inoculated with E. coli O157:H7 and S. aureus during storage at abuse refrigeration temperature.
PubMed:Analysis and optimization of a synthetic milkweed floral attractant for mosquitoes.
PubMed:Identification of mosquito repellent odours from Ocimum forskolei.
PubMed:Specialist leaf beetle larvae use volatiles from willow leaves infested by conspecifics for reaggregation in a tree.
PubMed:Responses of the Asian citrus psyllid to volatiles emitted by the flushing shoots of its rutaceous host plants.
PubMed:Genetic variation in jasmonic acid- and spider mite-induced plant volatile emission of cucumber accessions and attraction of the predator Phytoseiulus persimilis.
PubMed:An antiaphrodisiac in Heliconius melpomene butterflies.
PubMed:Odor-mediated push-pull pollination in cycads.
PubMed:Interspecific variation of floral scent composition in Glochidion and its association with host-specific pollinating seed parasite (Epicephala).
PubMed:Volatile constituents and key odorants in leaves, buds, flowers, and fruits of Laurus nobilis L.
PubMed:Behavioral and electrophysiological responses of natural enemies to synomones from tea shoots and kairomones from tea aphids, Toxoptera aurantii.
PubMed:Aroma compound analysis of Piper nigrum and Piper guineense essential oils from Cameroon using solid-phase microextraction-gas chromatography, solid-phase microextraction-gas chromatography-mass spectrometry and olfactometry.
PubMed:Comparison of cultivars of ornamental crop Gerbera jamesonii on production of spider mite-induced volatiles, and their attractiveness to the predator Phytoseiulus persimilis.
PubMed:Exogenous methyl jasmonate induces volatile emissions in cotton plants.
PubMed:Application of acid-catalyzed hydrolysis of dispersed organic solvent in developing new microencapsulation process technology.
PubMed:Investigation on structural integrity of PLGA during ammonolysis-based microencapsulation process.
PubMed:Nonhalogenated solvent-based solvent evaporation process useful in preparation of PLGA microspheres.
PubMed:Ammonolysis-based microencapsulation technique using isopropyl formate as dispersed solvent.
 
Notes:
Flavouring compound [Flavornet]
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