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2-pentyl 2-methyl pentanoate
2-pentyl 2-methylpentanoate

Supplier Sponsors

CAS Number: 90397-36-7Picture of molecule3D/inchi
FDA UNII:F9V9W3014W
XlogP3-AA:3.70 (est)
Molecular Weight:186.29474000
Formula:C11 H22 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:flavoring 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:2072 2-pentyl 2-methylpentanoate
FEMA Number:4401 2-pentyl 2-methylpentanoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):90397-36-7 ; 2-PENTYL 2-METHYLPENTANOATE
 
Physical Properties:
Appearance:colorless to yello clear liquid (est)
Assay: 99.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.84700 to 0.85300 @ 20.00 °C.
Pounds per Gallon - (est).: 7.056 to 7.106
Refractive Index:1.41000 to 1.46000 @ 20.00 °C.
Boiling Point: 76.00 to 77.00 °C. @ 10.00 mm Hg
Soluble in:
 water, 14.51 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
pear
Odor Description:at 10.00 % in dipropylene glycol. pear
Flavor Type: fruity
pear
Taste Description: pear
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Parchem
2-pentyl 2-methyl pentanoate
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: flavoring agents
Recommendation for 2-pentyl 2-methyl pentanoate usage levels up to:
 not for fragrance use.
 
Structure Class: I
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: 0.020000.10000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: 0.100000.50000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 0.010000.05000
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 0.020000.10000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: 0.010000.05000
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: 2.5000010.00000
soft candy: 0.020000.10000
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :57090934
National Institute of Allergy and Infectious Diseases:Data
pentan-2-yl 2-methylpentanoate
Chemidplus:0090397367
 
References:
 pentan-2-yl 2-methylpentanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):57090934
Pubchem (sid):135347855
 
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):Search
FooDB:FDB010042
ChemSpider:View
FAO:2-Pentyl 2-methylpentanoate
 
Potential Blenders and core components note
For Odor
alcoholic
propyl alcohol
FL/FR
animal
methyl (E)-2-octenoate
FL/FR
fatty
3-
decen-2-one
FL/FR
fermented
hexanal diethyl acetal
FL/FR
floral
citronellyl acetate
FL/FR
(S)-
citronellyl acetate
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
(E)-
geranyl acetone
FL/FR
hexyl 2-furoate
FL/FR
hexyl lactate
FL/FR
neryl acetate
FL/FR
fruity
amyl acetate
FL/FR
iso
amyl butyrate
FL/FR
amyl hexanoate
FL/FR
benzyl butyrate
FL/FR
iso
butyl 2-butenoate
FL/FR
butyl isovalerate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl (Z)-4-octenoate
FL/FR
ethyl cyclohexane propionate
FL/FR
(E)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl isobutyrate
FL/FR
hexyl (E)-tiglate
FL/FR
hexyl acetate
FL/FR
hexyl isovalerate
FL/FR
hexyl propionate
FL/FR
linalyl hexanoate
FL/FR
3-
mercaptohexyl acetate
FL/FR
methyl (E,Z)-2,4-decadienoate
FL/FR
methyl (Z)-4-decenoate
FL/FR
methyl 2-methyl butyrate
FL/FR
methyl 3-nonenoate
FL/FR
2-
methyl butyl butyrate
FL/FR
methyl nonanoate
FL/FR
methyl octadienoate
FL/FR
neryl isobutyrate
FL/FR
(Z)-3-
octen-1-yl propionate
FL/FR
pear essence
FL/FR
prenyl acetate
FL/FR
iso
propyl 2-methyl butyrate
FL/FR
propyl 2,4-decadienoate
FL/FR
propyl acetate
FL/FR
propyl heptanoate
FL/FR
iso
propyl isobutyrate
FL/FR
pyrus communis fruit extract
FL/FR
tropical dienoate
FL/FR
green
cognac heptanone
FL/FR
diphenyl methane
FL/FR
ethyl (E,Z)-2,4-decadienoate
FL/FR
ethyl (E)-4-decenoate
FL/FR
green note propionate
FL/FR
heptyl acetate
FL/FR
(Z)-3-
hexen-1-yl (E)-2-hexenoate
FL/FR
(Z)-3-
hexen-1-yl (Z)-3-hexenoate
FL/FR
(Z)-3-
hexen-1-yl 2-methyl butyrate
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
(Z)-3-
hexen-1-yl hexanoate
FL/FR
(E)-2-
hexen-1-yl isovalerate
FL/FR
(Z)-3-
hexen-1-yl propionate
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
3-
hexenyl 2-methyl butyrate
FL/FR
hexyl isobutyrate
FL/FR
melon nonenoate
FL/FR
methyl (E)-3-hexenoate
FL/FR
(E,Z)-3,6-
nonadien-1-ol
FL/FR
(E,Z)-3,6-
nonadien-1-yl acetate
FL/FR
3,6-
nonadien-1-yl acetate
FL/FR
(E)-2-
octen-1-yl acetate
FL/FR
3-
octyl formate
FL/FR
(E,E)-
sorbyl isobutyrate
FL/FR
sorbyl isobutyrate
FL/FR
melon
(Z)-6-
nonen-1-yl acetate
FL/FR
spicy
cinnamyl isovalerate
FL/FR
sulfurous
4-
tropical oxathiane
FL/FR
tropical
ethyl (Z)-3-hexenoate
FL/FR
waxy
tetradecanal
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
For Flavor
No flavor group found for these
acetone
FL
9-
decen-2-one
FL
ethyl (Z)-3-hexenoate
FL/FR
ethyl cyclohexane propionate
FL/FR
3-
heptyl acetate
FL
hexanal diethyl acetal
FL/FR
2-
hexyl acetate
FL
hexyl propionate
FL/FR
linalyl hexanoate
FL/FR
methyl (E,Z)-2,4-decadienoate
FL/FR
methyl (Z)-4-decenoate
FL/FR
methyl octadienoate
FL/FR
iso
propyl isobutyrate
FL/FR
(E,E)-
sorbyl isobutyrate
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
sorbyl isobutyrate
FL/FR
alcoholic
alcoholic
propyl alcohol
FL/FR
citrus
cognac heptanone
FL/FR
estery
propyl acetate
FL/FR
fatty
ethyl (E)-4-decenoate
FL/FR
tetradecanal
FL/FR
floral
(S)-
citronellyl acetate
FL/FR
citronellyl acetate
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
(E)-
geranyl acetone
FL/FR
neryl acetate
FL/FR
fruity
amyl acetate
FL/FR
amyl hexanoate
FL/FR
benzyl butyrate
FL/FR
butyl isovalerate
FL/FR
cinnamyl isovalerate
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl (Z)-4-octenoate
FL/FR
furfuryl propionate
FL
(Z)-3-
hexen-1-yl (E)-2-hexenoate
FL/FR
(E)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl isobutyrate
FL/FR
hexyl acetate
FL/FR
hexyl lactate
FL/FR
methyl (E)-2-octenoate
FL/FR
methyl (E)-3-nonenoate
FL
methyl 2-methyl butyrate
FL/FR
methyl 3-nonenoate
FL/FR
2-
methyl butyl butyrate
FL/FR
neryl isobutyrate
FL/FR
(Z)-3-
nonen-1-yl acetate
FL
(Z)-3-
octen-1-yl propionate
FL/FR
pear distillates
FL
pear enhancers
FL
pear essence
FL/FR
comice
pear flavor
FL
pear flavor
FL
bartlett
pear flavor
FL
asian
pear flavor
FL
pear flavor for chocolate
FL
pear juice concentrate
FL
prenyl acetate
FL/FR
iso
propyl 2-methyl butyrate
FL/FR
pyrus communis fruit extract
FL/FR
salacca zalacca fruit
FL
snake fruit flavor
FL
tropical dienoate
FL/FR
4-
tropical oxathiane
FL/FR
green
iso
butyl 2-butenoate
FL/FR
3-
decen-2-one
FL/FR
diphenyl methane
FL/FR
ethyl (E,Z)-2,4-decadienoate
FL/FR
green note propionate
FL/FR
heptyl acetate
FL/FR
(Z)-3-
hexen-1-yl (Z)-3-hexenoate
FL/FR
(Z)-3-
hexen-1-yl 2-methyl butyrate
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl butyrate
FL/FR
(Z)-3-
hexen-1-yl hexanoate
FL/FR
(E)-2-
hexen-1-yl isovalerate
FL/FR
(E)-2-
hexen-1-yl propionate
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
(Z)-3-
hexen-1-yl valerate
FL/FR
3-
hexenyl 2-methyl butyrate
FL/FR
hexyl (E)-tiglate
FL/FR
hexyl 2-furoate
FL/FR
hexyl isobutyrate
FL/FR
hexyl isovalerate
FL/FR
melon nonenoate
FL/FR
methyl (E)-3-hexenoate
FL/FR
(E,Z)-3,6-
nonadien-1-ol
FL/FR
(E,Z)-3,6-
nonadien-1-yl acetate
FL/FR
3,6-
nonadien-1-yl acetate
FL/FR
(Z)-6-
nonen-1-yl acetate
FL/FR
(E,E)-2,4-
octadienal
FL
2,4-
octadienal
FL
(E)-2-
octen-1-yl acetate
FL/FR
melon
propyl 2,4-decadienoate
FL/FR
tropical
3-
mercaptohexyl acetate
FL/FR
waxy
iso
amyl butyrate
FL/FR
3-
octyl formate
FL/FR
propyl heptanoate
FL/FR
winey
methyl nonanoate
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
2-methyl pentanoic acid 2-pentyl ester
 pentan-2-yl 2-methylpentanoate
 pentanoic acid, 2-methyl-, 1-methylbutyl ester
(+/-)-2-pentyl 2-methylpentanoate
2-pentyl 2-methylpentanoate
2-pentyl 2-methylpentanoate, (+/-)-
 

Articles:

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