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

isoamyl geranate
3-methylbutyl (E)-3,7-dimethyl-2,6-octadienoate

Sponsors

Name:3-methylbutyl (2E)-3,7-dimethylocta-2,6-dienoate
CAS Number: 68133-73-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:268-700-0
Nikkaji Web:J65.640B
XlogP3-AA:5.10 (est)
Molecular Weight:238.37062000
Formula:C15 H26 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:cosmetic and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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NCBI:Search
 
Physical Properties:
Appearance:colorless clear oily liquid (est)
Assay: 95.00 to 100.00 sum of isomers
Food Chemicals Codex Listed: No
Boiling Point: 110.00 °C. @ 1.00 mm Hg
Vapor Pressure:0.000500 mm/Hg @ 25.00 °C. (est)
Flash Point:> 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 5.508 (est)
Soluble in:
 alcohol
 water, 0.2633 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
ethyl geranate
methyl cyclogeranate
(E)-methyl geranate
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
rose lemon honey hay
Odor Description:at 100.00 %. rose lemon honey hay
Odor and/or flavor descriptions from others (if found).
Bedoukian Research
ISOAMYL GERANATE ≥95.0%, Kosher
Odor Description:A rose. Lemon. honey character
A long lasting interesting addition to rose, honey, herbal or lemon fragrances.
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Bedoukian Research
ISOAMYL GERANATE
≥95.0%, Kosher
Odor: A rose. Lemon. honey character
Use: A long lasting interesting addition to rose, honey, herbal or lemon fragrances.
Penta International
ISOAMYL GERANATE, Kosher
 
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:
oral-rat LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 17, Pg. 831, 1979.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 17, Pg. 831, 1979.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: cosmetic and fragrance agents
Recommendation for isoamyl geranate usage levels up to:
  8.0000 % in the fragrance concentrate.
 
Recommendation for isoamyl geranate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):68133-73-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :6435040
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
3-methylbutyl (2E)-3,7-dimethylocta-2,6-dienoate
Chemidplus:0068133733
 
References:
 3-methylbutyl (2E)-3,7-dimethylocta-2,6-dienoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:68133-73-3
Pubchem (cid):6435040
Pubchem (sid):135010579
 
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
Export Tariff Code:2916.19.6000
ChemSpider:View
 
Potential Blenders and core components note
For Odor
acidic
cyclohexyl acetic acid
FL/FR
aldehydic
citronellyl oxyacetaldehyde
FL/FR
nonanal diethyl acetal
FL/FR
animal
para-
cresyl phenyl acetate
FL/FR
1,2,3,4-
tetrahydroquinoline
FR
anisic
para-
anisyl phenyl acetate
FL/FR
balsamic
guaiacyl phenyl acetate
FL/FR
2-
phenyl propyl alcohol
FL/FR
bready
bran resinoid
FR
caramellic
immortelle absolute
FL/FR
cereal
bran absolute
FR
chocolate
iso
amyl phenyl acetate
FL/FR
cocoa pentenal
FL/FR
citrus
lemon scented
tea tree oil
FR
fatty
methyl (E)-2-hexenoate
FL/FR
floral
aeolanthus graveolens oil
FR
iso
amyl undecylenate
FL/FR
benzyl alcohol
FL/FR
butyl benzyl ether
FL/FR
cardamom absolute
FL/FR
citronellal
FL/FR
citronellyl isovalerate
FL/FR
citronellyl phenyl acetate
FL/FR
citronellyl propionate
FL/FR
citronellyl valerate
FL/FR
(Z)-alpha-
damascone
FL/FR
gamma-
damascone
FR
(Z)-4-
decen-1-yl acetate
FL/FR
decyl formate
FR
dihydrocarvyl acetate
FL/FR
ethyl hydrocinnamate
FL/FR
ethyl phenyl acetate
FL/FR
farnesyl acetate
FL/FR
floral pyran
FR
geranium rose-scented oil cuba
FR
geranyl acetate
FL/FR
geranyl anthranilate
FR
(E)-
geranyl linalool
FL/FR
geranyl phenyl acetate
FL/FR
hawthorn ethanol
FR
honeysuckle absolute
FR
hyacinth acetals
FL/FR
kewda oil
CS
linalyl phenyl acetate
FL/FR
ortho-
methyl acetophenone
FL/FR
2-
methyl octanal
FL/FR
musk acetate
FR
neryl acetate
FL/FR
neryl isovalerate
FL/FR
nonanol
FL/FR
octyl isovalerate
FL/FR
bitter
orangeflower absolute morocco
FL/FR
phenethyl acetate
FL/FR
phenethyl anthranilate
FL/FR
phenethyl benzoate
FL/FR
phenethyl hexanoate
FL/FR
phenethyl phenyl acetate
FL/FR
phenethyl propionate
FL/FR
phenethyl salicylate
FL/FR
phenyl acetaldehyde digeranyl acetal
FR
phenyl amyl alcohol
FL/FR
phenyl glycol diacetate
FR
3-
phenyl propyl formate
FL/FR
(E)-2-
phenyl-1(2)-propene-1-yl acetate
FR
iso
propyl anthranilate
FL/FR
iso
propyl phenyl acetate
FL/FR
rhodinyl phenyl acetate
FL/FR
rose absolute (rosa centifolia) morocco
FL/FR
rose carboxylate
FR
laevo-
rose oxide
FL/FR
styralyl propionate
FL/FR
tuberose absolute (from concrete)
FL/FR
tuberose absolute (from pommade)
FL/FR
(E)-2-
undecen-1-ol
FL/FR
2-
undecen-1-ol
FL/FR
2-
undecen-1-ol
FL/FR
fruity
allyl phenoxyacetate
FL/FR
(Z)-beta-
damascone
FL/FR
(E)-alpha-
damascone
FL/FR
beta-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
(Z)-3-
octen-1-yl propionate
FL/FR
osmanthus flower absolute
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
strawberry glycidate 2
FL/FR
green
iso
decanal
FL/FR
(E)-2-
hexen-1-yl phenyl acetate
FL/FR
4-
methyl-4-phenyl pentanone
FR
(Z,Z)-3,6-
nonadien-1-ol
FL/FR
phenyl acetaldehyde
FL/FR
hay
beeswax absolute
FL/FR
herbal
artemisyl ketone
FL/FR
american
elder flower absolute
FR
lavender absolute france
FL/FR
matricaria chamomilla flower oil
FL/FR
honey
allyl phenyl acetate
FL/FR
butyl phenyl acetate
FL/FR
methyl hydrocinnamate
FL/FR
methyl phenyl acetate
FL/FR
phenethyl furoate
FL/FR
phenyl acetic acid
FL/FR
phenyl pyruvic acid
FL/FR
propyl phenyl acetate
FL/FR
melon
(Z)-6-
nonen-1-ol
FL/FR
musty
cocoa butenal
FL/FR
spicy
carnation absolute
FR
eugenyl phenyl acetate
FL/FR
iso
eugenyl phenyl acetate
FL/FR
thujonic
cistus cyclohexanone
FL/FR
tropical
genet absolute
FL/FR
waxy
dihydrocitronellyl acetate
FL/FR
1-
dodecanol
FL/FR
methyl butyl phenyl acetate
FL/FR
waxy acetate
FR
waxy acetate
FR
woody
santalyl phenyl acetate
FL/FR
For Flavor
No flavor group found for these
1-
acetyl cyclohexyl acetate
FL
iso
amyl undecylenate
FL/FR
artemisyl ketone
FL/FR
butyl benzyl ether
FL/FR
cistus cyclohexanone
FL/FR
citronellyl isovalerate
FL/FR
citronellyl valerate
FL/FR
(Z)-alpha-
damascone
FL/FR
iso
decanal
FL/FR
(Z)-4-
decen-1-yl acetate
FL/FR
dihydrocitronellyl acetate
FL/FR
ethyl hydrocinnamate
FL/FR
eugenyl phenyl acetate
FL/FR
fig leaf absolute
FL
(E)-
geranyl linalool
FL/FR
(E)-2-
hexen-1-yl phenyl acetate
FL/FR
linalyl phenyl acetate
FL/FR
methyl (E)-2-hexenoate
FL/FR
methyl hydrocinnamate
FL/FR
2-
methyl octanal
FL/FR
nonanal diethyl acetal
FL/FR
octyl isovalerate
FL/FR
osmanthus flower absolute
FL/FR
phenethyl furoate
FL/FR
phenyl amyl alcohol
FL/FR
3-
phenyl propyl formate
FL/FR
iso
propyl anthranilate
FL/FR
santalyl phenyl acetate
FL/FR
2-
undecen-1-ol
FL/FR
2-
undecen-1-ol
FL/FR
(E)-2-
undecen-1-ol
FL/FR
beta-
damascone
FL/FR
anisic
anisic
para-
anisyl phenyl acetate
FL/FR
ortho-
methyl acetophenone
FL/FR
aromatic
hyacinth acetals
FL/FR
brown
beeswax absolute
FL/FR
citrus
citronellyl oxyacetaldehyde
FL/FR
styralyl propionate
FL/FR
floral
iso
amyl phenyl acetate
FL/FR
cardamom absolute
FL/FR
citronellal
FL/FR
citronellyl phenyl acetate
FL/FR
citronellyl propionate
FL/FR
cocoa pentenal
FL/FR
dihydrocarvyl acetate
FL/FR
farnesyl acetate
FL/FR
geranyl phenyl acetate
FL/FR
methyl phenyl acetate
FL/FR
neryl acetate
FL/FR
bitter
orangeflower absolute morocco
FL/FR
phenethyl anthranilate
FL/FR
phenethyl benzoate
FL/FR
phenethyl propionate
FL/FR
phenyl acetic acid
FL/FR
rose absolute (rosa centifolia) morocco
FL/FR
laevo-
rose oxide
FL/FR
tuberose absolute (from concrete)
FL/FR
tuberose absolute (from pommade)
FL/FR
fruity
allyl phenoxyacetate
FL/FR
benzyl alcohol
FL/FR
(E)-alpha-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
(Z)-beta-
damascone
FL/FR
neryl isovalerate
FL/FR
(Z)-3-
octen-1-yl propionate
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
strawberry glycidate 2
FL/FR
green
cocoa butenal
FL/FR
geranyl acetate
FL/FR
(E)-3-
hexenoic acid
FL
immortelle absolute
FL/FR
2-
phenyl propyl alcohol
FL/FR
hay
genet absolute
FL/FR
herbal
lavender absolute france
FL/FR
matricaria chamomilla flower oil
FL/FR
honey
allyl phenyl acetate
FL/FR
butyl phenyl acetate
FL/FR
ethyl phenyl acetate
FL/FR
phenethyl acetate
FL/FR
phenethyl phenyl acetate
FL/FR
phenyl acetaldehyde
FL/FR
propyl phenyl acetate
FL/FR
iso
propyl phenyl acetate
FL/FR
leafy
methyl butyl phenyl acetate
FL/FR
medicinal,
phenethyl salicylate
FL/FR
phenolic
para-
cresyl phenyl acetate
FL/FR
guaiacyl phenyl acetate
FL/FR
phenyl pyruvic acid
FL/FR
soapy
1-
dodecanol
FL/FR
sour
2,4-
dimethyl-2-pentenoic acid
FL
spicy
iso
eugenyl phenyl acetate
FL/FR
sweet
cyclohexyl acetic acid
FL/FR
waxy
(Z,Z)-3,6-
nonadien-1-ol
FL/FR
nonanol
FL/FR
(Z)-6-
nonen-1-ol
FL/FR
phenethyl hexanoate
FL/FR
rhodinyl phenyl acetate
FL/FR
 
Potential Uses:
FRcitrus
FRherbal
FRhoney
FRlemon
FRrose
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
(E)-isoamyl geranate
(E)-3,7-dimethyl-2,6-octadienoic acid 3-methyl butyl ester
(E)-3,7-dimethyl-2,6-octadienoic acid isopentyl ester
3-methyl butyl (E)-3,7-dimethyl octa-2,6-dienoate
3-methyl butyl (E)-3,7-dimethyl-2,6-octadienoate
3-methylbutyl (2E)-3,7-dimethylocta-2,6-dienoate
3-methylbutyl (E)-3,7-dimethyl-2,6-octadienoate
3-methylbutyl (E)-3,7-dimethylocta-2,6-dienoate
2,6-octadienoic acid 3,7-dimethyl-,3-methylbutyl ester,(2E)-
2,6-octadienoic acid, 3,7-dimethyl-, 3-methylbutyl ester, (2E)-
2,6-octadienoic acid, 3,7-dimethyl-, 3-methylbutyl ester, (E)-
2,6-octadienoic acid, 3,7-dimethyl-, isopentyl ester, (E)-
isopentyl geranate
 
 
Notes:
None found
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