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

trans-1-ethyl-2-methyl propyl 2-butenoate
but-2-enoic acid (E)-1-ethyl-2-methylpropyl ester

Supplier Sponsors

Name:2-methylpentan-3-yl (E)-but-2-enoate
CAS Number: 1370711-06-0Picture of molecule3D/inchi
FDA UNII: VIA9EBA02X
XlogP3-AA:3.20 (est)
Molecular Weight:170.25186000
Formula:C10 H18 O2
NMR Predictor:Predict (works with chrome, Edge 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
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
FEMA Number:4818 trans-1-ethyl-2-methylpropyl 2-butenoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 65.00 °C. @ 0.60 mm Hg
Soluble in:
 water, 69.56 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Type: fruity
fruity woody sugar sweet fresh
Odor Description:at 10.00 % in dipropylene glycol. very powerful and complex with unique fruity and woody combination. Toppy and rich with sugary feel, sweet, and fresh
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
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
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
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: 28
Click here to view publication 28
 average usual ppmaverage maximum ppm
baked goods: 0.400004.00000
beverages(nonalcoholic): 0.200002.00000
beverages(alcoholic): 0.200002.00000
breakfast cereal: 0.400004.00000
cheese: 0.100000.50000
chewing gum: 0.500005.00000
condiments / relishes: --
confectionery froastings: 0.400004.00000
egg products: --
fats / oils: --
fish products: --
frozen dairy: 0.500005.00000
fruit ices: 0.200002.00000
gelatins / puddings: 0.200002.00000
granulated sugar: --
gravies: --
hard candy: 0.400004.00000
imitation dairy: --
instant coffee / tea: 0.100001.00000
jams / jellies: 1.000005.00000
meat products: --
milk products: 0.200002.00000
nut products: --
other grains: --
poultry: --
processed fruits: 0.400004.00000
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 0.200002.00000
snack foods: 0.200002.00000
soft candy: 0.400004.00000
soups: --
sugar substitutes: --
sweet sauces: 0.200002.00000
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):1370711-06-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :90266236
National Institute of Allergy and Infectious Diseases:Data
2-methylpentan-3-yl (E)-but-2-enoate
Chemidplus:1370711060
 
References:
 2-methylpentan-3-yl (E)-but-2-enoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):90266236
Pubchem (cas):1370711-06-0
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (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
 
Potential Blenders and core components note
For Odor
balsamic
iso
bornyl propionate
FL/FR
fir carboxylate
FR
scotch
pine wood/needles resinoid
FR
tolu balsam replacer
FR
berry
raspberry ketone methyl ether
FL/FR
earthy
orris specialty
FR
fatty
hexyl pivalate
FR
floral
anise indene
FR
benzaldehyde propylene glycol acetal
FL/FR
boronia absolute
FL/FR
boronia absolute replacer
FL/FR
boronia fragrance
FR
bursera graveolens wood oil
FL/FR
2,4-
dimethyl cyclohexyl methyl acetate
FR
ionone mixed isomers
FL/FR
linalyl propionate
FL/FR
N-
methyl ionone
FR
orris fragrance
FR
fruity
brandy extract
FL/FR
buchu wood specialty
FL/FR
1-(3,3-
dimethyl bicyclo(2.2.1)hept-2-yl)-2-methyl cyclohex-3-ene carbaldehyde
FR
1,4-
dimethyl bicyclo(3.2.1)oct-3-yl acetate
FR
1,2-
dimethyl butyl 2-butenoate
FR
geranyl acetoacetate
FL/FR
green acetate
FR
heptyl isovalerate
FL/FR
methyl (Z)-5-octenoate
FL/FR
octyl propionate
FL/FR
2-
pentanone
FL/FR
perillyl acetate
FL/FR
pineapple hydroxyhexanoate
FL/FR
herbal
bornyl 2-methyl butyrate
FL/FR
bornyl butyrate
FL/FR
herbal specialty
FR
herbal undecanone
FR
methyl cyclogeranate (Firmenich)
FR
tricyclodecenyl propionate
FR
spicy
clove bud absolute
FL/FR
clove bud oil
FL/FR
clove bud oil replacer
FR
clove fragrance
FR
N,N-
diethyl octanamide
FR
green oxane
FR
pepper tree berry oil CO2 extract
FL/FR
waxy
orris rhizome oil CO2 extract
FL/FR
woody
melozol acetate
FR
spicy pentanone
FL/FR
1-(5',5',6'-
trimethyl bicyclo(2.2.1)hept-2'-ylidene) propan-2-one
FR
For Flavor
No flavor group found for these
bornyl 2-methyl butyrate
FL/FR
bornyl butyrate
FL/FR
boronia absolute replacer
FL/FR
buchu wood specialty
FL/FR
bursera graveolens wood oil
FL/FR
heptyl isovalerate
FL/FR
ionone mixed isomers
FL/FR
balsamic
balsamic
iso
bornyl propionate
FL/FR
berry
raspberry ketone methyl ether
FL/FR
dairy
methyl (Z)-5-octenoate
FL/FR
estery
octyl propionate
FL/FR
fruity
benzaldehyde propylene glycol acetal
FL/FR
boronia absolute
FL/FR
brandy extract
FL/FR
2-
pentanone
FL/FR
pineapple hydroxyhexanoate
FL/FR
spicy pentanone
FL/FR
green
perillyl acetate
FL/FR
herbal
linalyl propionate
FL/FR
musty
geranyl acetoacetate
FL/FR
spicy
clove bud absolute
FL/FR
clove bud oil
FL/FR
pepper tree berry oil CO2 extract
FL/FR
woody
orris rhizome oil CO2 extract
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 but-2-enoic acid (E)-1-ethyl-2-methyl propyl ester
 but-2-enoic acid (E)-1-ethyl-2-methylpropyl ester
2-butenoic acid, 1-ethyl-2-methylpropyl ester, (2E)-
1-ethyl-2-methylpropyl (2E)-2-butenoic acid ester
trans-1-ethyl-2-methylpropyl 2-butenoate
2-methylpentan-3-yl (E)-but-2-enoate
 
 
Notes:
None found
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