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(E)-2-hexen-1-yl 2-methyl butyrate
trans-2-hexenyl 2-methylbutyrate

Supplier Sponsors

Name:[(E)-hex-2-enyl] 2-methylbutanoate
CAS Number: 94089-01-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:302-103-9
FDA UNII:K6390PB417
Nikkaji Web:J288.578F
XlogP3-AA:3.40 (est)
Molecular Weight:184.27880000
Formula:C11 H20 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
JECFA Food Flavoring:1797 trans-2-hexenyl 2-methylbutyrate
FEMA Number:4274 trans-2-hexenyl 2-methylbutyrate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):94089-01-7 ; TRANS-2-HEXENYL 2-METHYLBUTYRATE
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.87400 to 0.87900 @ 20.00 °C.
Pounds per Gallon - (est).: 7.281 to 7.323
Refractive Index:1.43000 to 1.43400 @ 20.00 °C.
Boiling Point: 231.00 to 232.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.062000 mmHg @ 25.00 °C. (est)
Flash Point: 175.00 °F. TCC ( 79.44 °C. )
logP (o/w): 3.990 (est)
Soluble in:
 alcohol
 water, 19.61 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
isoamyl 2-methyl butyrate
amyl 2-methyl butyrate
benzyl 2-methyl butyrate
bornyl 2-methyl butyrate
butyl 2-methyl butyrate
isobutyl 2-methyl butyrate
citronellyl 2-methyl butyrate
ethyl 2-hydroxy-2-methyl butyrate
(±)-ethyl 3-acetoxy-2-methyl butyrate
(±)-ethyl 3-hydroxy-2-methyl butyrate
ethyl 2-methyl butyrate
furfuryl 2-methyl butyrate
geranyl 2-methyl butyrate
heptyl 2-methyl butyrate
(Z)-3-hexen-1-yl 2-methyl butyrate
3-hexen-1-yl 2-methyl butyrate
hexyl 2-methyl butyrate
methyl 3-acetoxy-2-methyl butyrate
2-methyl butyl 2-methyl butyrate
methyl 2-methyl butyrate
octyl 2-methyl butyrate
propyl 2-methyl butyrate
isopropyl 2-methyl butyrate
propylene glycol di-2-methyl butyrate
propylene glycol mono-2-methyl butyrate
 
Organoleptic Properties:
Odor Description:fruity
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
trans-2-Hexenyl 2-methyl butyrate
CJ Latta & Associates
TRANS-2-HEXENYL 2-METHYL BUTYRATE
Inoue Perfumery
TRANS-2-HEXENYL 2-METHYLBUTYRATE
Parchem
(E)-2-hexen-1-yl 2-methyl butyrate
Penta International
TRANS-2-HEXENYL-2-METHYL BUTYRATE
 
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
Recommendation for (E)-2-hexen-1-yl 2-methyl butyrate usage levels up to:
  2.0000 % in the fragrance concentrate.
 
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 23
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): 3.0000015.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: 25.00000100.00000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: 10.0000020.00000
granulated sugar: --
gravies: --
hard candy: 5.0000025.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: 5.0000020.00000
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5352459
National Institute of Allergy and Infectious Diseases:Data
[(E)-hex-2-enyl] 2-methylbutanoate
Chemidplus:0094089017
 
References:
 [(E)-hex-2-enyl] 2-methylbutanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):5352459
Pubchem (sid):135217158
 
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
FDA Substances Added to Food (formerly EAFUS):View
HMDB (The Human Metabolome Database):HMDB32534
FooDB:FDB010404
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
(E)-
tiglaldehyde
FL/FR
animal
animal
para-
cresyl isobutyrate
FL/FR
balsamic
fir carboxylate
FR
fatty
allyl octanoate
FL/FR
3-
decen-2-one
FL/FR
hexyl pivalate
FR
methyl 2-hexenoate
FL/FR
fermented
3-
methyl-1-pentanol
FL/FR
floral
alpha-
amyl cinnamaldehyde diethyl acetal
FR
citronellyl propionate
FL/FR
gamma-
damascone
FR
6,8-
dimethyl-2-nonanol
FR
(E)-
geranyl acetone
FL/FR
lily propanol
FR
papaya isobutyrate
FL/FR
rose butanoate
FL/FR
fruity
acetaldehyde dihexyl acetal
FL/FR
amyl hexanoate
FL/FR
berry pentadienoate
FL/FR
diethyl malonate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl 2-methyl butyrate
FL/FR
ethyl 3,5,5-trimethyl hexanoate
FR
ethyl acetoacetate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
geranyl isovalerate
FL/FR
green acetate
FR
heptyl isobutyrate
FL/FR
hexanal propylene glycol acetal
FL/FR
(Z)-3-
hexen-1-yl 2-methyl-2-pentenoate
FR
hexyl (E)-tiglate
FL/FR
hexyl acetate
FL/FR
hexyl isovalerate
FL/FR
hexyl propionate
FL/FR
linalyl hexanoate
FL/FR
methyl 2-methyl butyrate
FL/FR
methyl valerate
FL/FR
4-
phenyl-2-butyl acetate
FL/FR
propyl hexanoate
FL/FR
green
acetaldehyde benzyl 2-methoxyethyl acetal
FL/FR
acetaldehyde methyl hexyl acetal
FR
butyl 2-methyl butyrate
FL/FR
cognac heptanone
FL/FR
ethyl (E)-2-hexenoate
FL/FR
ethyl (E)-4-decenoate
FL/FR
green dioxolane
FR
(Z)-3-
hexen-1-yl (E)-2-hexenoate
FL/FR
(Z)-3-
hexen-1-yl 2-methyl butyrate
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(E)-2-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
(Z)-3-
hexen-1-yl hexanoate
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
(E)-2-
hexen-1-yl propionate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
(Z)-3-
hexen-1-yl valerate
FL/FR
2-
hexenyl acetate
FL/FR
hexyl butyrate
FL/FR
hexyl isobutyrate
FL/FR
(E)-2-
pentenal
FL/FR
phenoxyethyl isobutyrate
FL/FR
alpha-iso
propyl phenyl acetaldehyde
FL/FR
sorbyl isobutyrate
FL/FR
thiogeraniol
FL/FR
herbal
tagete oil india
FL/FR
spicy
cinnamyl isovalerate
FL/FR
sulfurous
mango thiol
FL/FR
tropical
2-
tropical oxathiane
FL/FR
waxy
9-
decenoic acid
FL/FR
(E)-
methyl geranate
FL/FR
nonyl acetate
FL/FR
woody
woody acetate
FR
For Flavor
No flavor group found for these
acetaldehyde benzyl 2-methoxyethyl acetal
FL/FR
allyl tiglate
FL
butyl 2-methyl butyrate
FL/FR
(E,E)-2,4-
heptadien-1-ol
FL
2-
hexenal diethyl acetal
FL
2-
hexenyl acetate
FL/FR
hexyl propionate
FL/FR
linalyl hexanoate
FL/FR
methyl 2-hexenoate
FL/FR
methyl 4-pentenoate
FL
(E)-
methyl geranate
FL/FR
4-
phenyl-2-butyl acetate
FL/FR
alpha-iso
propyl phenyl acetaldehyde
FL/FR
(E)-
tiglaldehyde
FL/FR
2-
tropical oxathiane
FL/FR
sorbyl isobutyrate
FL/FR
aromatic
aromatic
para-
cresyl isobutyrate
FL/FR
berry
heptyl isobutyrate
FL/FR
citrus
cognac heptanone
FL/FR
earthy
1-
hexen-3-yl acetate
FL
estery
ethyl acetoacetate
FL/FR
fatty
allyl octanoate
FL/FR
ethyl (E)-4-decenoate
FL/FR
floral
citronellyl propionate
FL/FR
(E)-
geranyl acetone
FL/FR
fruity
amyl hexanoate
FL/FR
berry pentadienoate
FL/FR
cinnamyl isovalerate
FL/FR
diethyl malonate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl (E)-2-hexenoate
FL/FR
ethyl 2-methyl butyrate
FL/FR
ethyl methyl-para-tolyl glycidate
FL/FR
hexanal propylene glycol acetal
FL/FR
(Z)-3-
hexen-1-yl (E)-2-hexenoate
FL/FR
hexyl acetate
FL/FR
methyl 2-methyl butyrate
FL/FR
methyl valerate
FL/FR
propyl hexanoate
FL/FR
rose butanoate
FL/FR
green
acetaldehyde dihexyl acetal
FL/FR
3-
decen-2-one
FL/FR
geranyl isovalerate
FL/FR
(Z)-3-
hexen-1-yl 2-methyl butyrate
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(E)-2-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
(Z)-3-
hexen-1-yl hexanoate
FL/FR
(Z)-3-
hexen-1-yl isovalerate
FL/FR
(E)-2-
hexen-1-yl propionate
FL/FR
(Z)-3-
hexen-1-yl valerate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
(E)-2-
hexenal diethyl acetal
FL
hexyl (E)-tiglate
FL/FR
hexyl butyrate
FL/FR
hexyl isobutyrate
FL/FR
hexyl isovalerate
FL/FR
4-
methyl-2-pentenal
FL
papaya isobutyrate
FL/FR
(E)-2-
pentenal
FL/FR
phenoxyethyl isobutyrate
FL/FR
herbal
tagete oil india
FL/FR
minty
thiogeraniol
FL/FR
sour
3-
methyl valeric acid
FL
sulfurous
mango thiol
FL/FR
waxy
9-
decenoic acid
FL/FR
nonyl acetate
FL/FR
whiskey
3-
methyl-1-pentanol
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 cotton levant cotton plants
Search Trop Picture
 
Synonyms:
 butanoic acid, 2-methyl-, (2E)-2-hexen-1-yl ester
 butyric acid, 2-methyl-, trans-hex-2-en-1-yl ester
(2E)-hex-2-en-1-yl 2-methylbutanoate
(E)-hex-2-enyl 2-methyl butyrate
trans-hex-2-enyl 2-methyl butyrate
(E)-hex-2-enyl 2-methylbutyrate
[(E)-hex-2-enyl] 2-methylbutanoate
(E)-2-hexen-1-yl 2-methyl butanoate
trans-2-hexen-1-yl 2-methyl butyrate
(E)-2-hexen-1-yl 2-methylbutanoate
trans-2-hexen-1-yl 2-methylbutanoate
(E)-2-hexen-1-yl 2-methylbutyrate
trans-2-hexenyl 2-methyl butanoate
trans-2-hexenyl 2-methylbutanoate
(E)-2-hexenyl 2-methylbutyrate
trans-2-hexenyl 2-methylbutyrate
trans-2-hexenyl-2-methyl butyrate
 

Articles:

 None found yet.
 
Notes:
Used as a food additive [EAFUS]
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