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ethyl citronellate
ethyl 3,7-dimethyl-6-octenoate

Supplier Sponsors

Name:ethyl 3,7-dimethyloct-6-enoate
CAS Number: 26728-44-9Picture of molecule3D/inchi
Nikkaji Web:J426.199B
XlogP3-AA:3.70 (est)
Molecular Weight:198.30574000
Formula:C12 H22 O2
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
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.88600 to 0.89400 @ 25.00 °C.
Pounds per Gallon - (est).: 7.372 to 7.439
Refractive Index:1.43600 to 1.44300 @ 20.00 °C.
Boiling Point: 240.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.026000 mmHg @ 25.00 °C. (est)
Flash Point: 219.00 °F. TCC ( 103.89 °C. )
logP (o/w): 4.196 (est)
Soluble in:
 alcohol
 water, 5.686 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:medium
fruity dry dusty citrus licorice rose spicy fennel
Odor Description:at 100.00 %. fruity dry dusty citrus sweet licorice rose spicy fennel
Odor sample from: Kingchem Laboratories Inc.
Flavor Type: dusty
dusty dry anise licorice fennel weedy
Taste Description: sweet dusty dry anise licorice fennel weedy
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Kingchem Laboratories
ETHYL CITRONELLATE
Odor: Fresh, intensely fruity and sweet, almost citrusy-rosy
Penta International
ETHYL CITRONELLATE
 
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 ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :549715
National Institute of Allergy and Infectious Diseases:Data
ethyl 3,7-dimethyloct-6-enoate
 
References:
 ethyl 3,7-dimethyloct-6-enoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):549715
Pubchem (sid):10351382
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
Export Tariff Code:2916.19.5000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
(Z)-8-
tetradecenal
FL/FR
aldehydic
aldehydic
(Z)-4-
dodecenal
FL/FR
amber
amber decane
FR
anise
anise seed oil
FL/FR
star
anise seed oil china
FL/FR
anise seed oil colombia
FL/FR
star
anise seed oil spain
FL/FR
sweet
fennel seed oil
FL/FR
foeniculum vulgare fruit extract
FL/FR
foeniculum vulgare mill. var. dulce d.c. fruit extract
FL/FR
anisic
ocimum basilicum herb oil egypt
FL/FR
ocimum basilicum leaf oil CO2 extract
FL/FR
ocimum basilicum leaf oil india
FL/FR
citrus
citronella oil java
FR
citronitrile (Symrise)
FR
2-
dodecanone
FL/FR
(Z+E)-2-
methyl-2-(4-methyl-3-pentenyl) cyclopropane carbaldehyde
FL/FR
1-
methyl-4-methyl ethenyl cyclohexene sulfurized
FL/FR
creamy
3-
heptyl dihydro-5-methyl-2(3H)-furanone
FL/FR
floral
bois de rose oil brazil
FL/FR
bursera graveolens wood oil
FL/FR
citronellal diisotridecyl acetal
FR
citronellol
FL/FR
citronellyl acetate
FL/FR
citronellyl anthranilate
FL/FR
citronellyl ethyl ether
FR
citronellyl hexanoate
FL/FR
(E)-
citronellyl tiglate
FL/FR
citrus propanol
FR
dihydrocitronellyl ethyl ether
FR
ethyl linalyl acetate
FR
ethyl ortho-anisate
FL/FR
geranyl isobutyrate
FL/FR
geranyl propionate
FL/FR
geranyl tiglate
FL/FR
geranyl valerate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
neryl isovalerate
FL/FR
petitgrain absolute morocco
FL/FR
phenethyl propionate
FL/FR
ortho-
phenyl anisole
FR
styralyl propionate
FL/FR
terpinyl formate
FL/FR
(E)-2,5,9-
trimethyl-4,9-decadien-1-al
FR
tuberose acetate
FR
fruity
iso
amyl 2-methyl butyrate
FL/FR
para-
anisyl methyl ketone
FL/FR
iso
butyl 2-butenoate
FL/FR
iso
butyl 2-methyl butyrate
FL/FR
ethyl isobutyrate
FL/FR
heptanal cyclic ethylene acetal
FR
methyl acetoacetate
FL/FR
iso
propyl isobutyrate
FL/FR
tropical specialty
FR
(E)-2-
undecenal
FL/FR
green
citrus carbaldehyde / methyl anthranilate schiff's base
FR
green carboxylate
FR
dextro-
limonene oxide
FL/FR
(2-
methoxy-1-methyl butyl) benzene
FR
phenyl acetaldehyde dimethyl acetal
FL/FR
3-
phenyl propionaldehyde
FL/FR
herbal
2-
dodecenal
FL/FR
geranium cyclohexane
FR
geranyl octanoate
FL/FR
linalyl formate
FL/FR
6-
methoxy-2,6-dimethyl octanal
FR
(1S,5R)-
myrtenyl acetate
FL/FR
licorice
ocimum basilicum herb oil vietnam
FL/FR
ocimum basilicum leaf oil terpeneless
FL/FR
powdery
para-
anisyl alcohol
FL/FR
spicy
artemisia dracunculus herb oil
FL/FR
clove bud concrete
FR
(E)-
tiglic acid
FL/FR
waxy
3-
decanone
FL/FR
dihydrocitronellyl acetate
FL/FR
woody
amber dioxane
FR
ambrene acetal
FR
For Flavor
No flavor group found for these
bursera graveolens wood oil
FL/FR
beta-
cubebene
FL
3-
decanone
FL/FR
dihydrocitronellyl acetate
FL/FR
dihydronootkatone
FL
(Z)-4-
dodecenal
FL/FR
ethyl ortho-anisate
FL/FR
geranyl octanoate
FL/FR
geranyl valerate
FL/FR
linalyl formate
FL/FR
3-
mercaptooctanal
FL
methyl acetoacetate
FL/FR
(Z+E)-2-
methyl-2-(4-methyl-3-pentenyl) cyclopropane carbaldehyde
FL/FR
3-
octyl butyrate
FL
iso
propyl isobutyrate
FL/FR
(Z)-8-
tetradecenal
FL/FR
dextro-
limonene oxide
FL/FR
anise
anise
anise seed oil
FL/FR
star
anise seed oil china
FL/FR
anise seed oil colombia
FL/FR
star
anise seed oil spain
FL/FR
sweet
fennel seed oil
FL/FR
foeniculum vulgare fruit extract
FL/FR
foeniculum vulgare mill. var. dulce d.c. fruit extract
FL/FR
anisic
ocimum basilicum herb oil egypt
FL/FR
brown
(E)-
tiglic acid
FL/FR
citrus
citrus enhancer
FL
dehydronootkatone
FL
1-
methyl-4-methyl ethenyl cyclohexene sulfurized
FL/FR
styralyl propionate
FL/FR
ethereal
ethyl isobutyrate
FL/FR
fatty
2-
dodecanone
FL/FR
2-
dodecenal
FL/FR
floral
bois de rose oil brazil
FL/FR
citronellol
FL/FR
citronellyl acetate
FL/FR
citronellyl hexanoate
FL/FR
geranyl isobutyrate
FL/FR
geranyl tiglate
FL/FR
pseudo
ionone
FL
petitgrain absolute morocco
FL/FR
phenethyl propionate
FL/FR
fruity
iso
amyl 2-methyl butyrate
FL/FR
para-
anisyl alcohol
FL/FR
iso
butyl 2-methyl butyrate
FL/FR
citronellyl anthranilate
FL/FR
3-
heptyl dihydro-5-methyl-2(3H)-furanone
FL/FR
neryl isovalerate
FL/FR
terpinyl formate
FL/FR
green
iso
butyl 2-butenoate
FL/FR
(E)-
citronellyl tiglate
FL/FR
(E)-2-
heptenal
FL
phenyl acetaldehyde dimethyl acetal
FL/FR
3-
phenyl propionaldehyde
FL/FR
herbal
basil distillates
FL
ocimum basilicum leaf oil CO2 extract
FL/FR
ocimum basilicum leaf oil india
FL/FR
licorice
anise flavor
FL
black
licorice flavor
FL
licorice flavor
FL
ocimum basilicum herb oil vietnam
FL/FR
ocimum basilicum leaf oil terpeneless
FL/FR
spicy
para-
anisyl methyl ketone
FL/FR
artemisia dracunculus herb oil
FL/FR
basil flavor
FL
waxy
geranyl propionate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
(E)-2-
undecenal
FL/FR
woody
(1S,5R)-
myrtenyl acetate
FL/FR
 
Potential Uses:
FRabronia
FRash mountain ash berry
FRbergamot
FRcalamus oil replacer
FRcedrat
FL/FRcilantro
FRcitronella
FRcitrus
FRcologne
FRcolonia
FLcuracao
FRginger
FRgrapefruit
FRkumquat
FRlemon
FRlemongrass
FRlime
FL/FRlitsea cubeba
FRmandarin
FRmelissa oil replacer
FRmock orange
FLnecterine
FRorange
FL/FRorange bitter orange peel
FRrhubarb
FRtangerine
FRverbena
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
 citronellic acid ethyl ester
 ethyl 3,7-dimethyl-6-octenoate
 ethyl 3,7-dimethyloct-6-enoate
 

Articles:

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Notes:
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