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

2-methyl butyl butyrate
butanoic acid, 2-methylbutyl ester

Supplier Sponsors

Name:2-methylbutyl butanoate
CAS Number: 51115-64-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:256-973-9
Nikkaji Web:J77.602E
XlogP3-AA:2.60 (est)
Molecular Weight:158.24086000
Formula:C9 H18 O2
NMR Predictor:Predict (works with chrome or firefox)
EFSA/JECFA Comments:
Racemate.
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
PubMed:Search
NCBI:Search
FLAVIS Number:09.659 (Old)
DG SANTE Food Flavourings:09.659 2-methylbutyl butyrate
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.86200 to 0.86800 @ 25.00 °C.
Pounds per Gallon - (est).: 7.173 to 7.223
Refractive Index:1.40800 to 1.41400 @ 20.00 °C.
Boiling Point: 176.00 to 177.00 °C. @ 760.00 mm Hg
Vapor Pressure:1.090000 mm/Hg @ 25.00 °C. (est)
Flash Point: 138.00 °F. TCC ( 58.89 °C. )
logP (o/w): 3.177 (est)
Soluble in:
 alcohol
 water, 117.8 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:medium
fruity pear apricot apple tropical gooseberry spicy rummy
Odor Description:at 100.00 %. fruity pear apricot apple tropical gooseberry spicy rummy
Odor sample from: Kingchem Laboratories Inc.
Flavor Type: fruity
fruity tutti frutti apricot gooseberry tropical pear rummy
Taste Description: sweet fruity tutti frutti apricot gooseberry tropical
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Alfrebro
2-METHYL BUTYL-n-BUTYRATE NATURAL
Odor: Fruity, Pear, Apple, Ester
BOC Sciences
For experimental / research use only.
2-Methylbutyl Butyrate
ECSA Chemicals
Methyl-2-butyl Butyrate
Company Profile
Grau Aromatics
METHYL-2-BUTYL-BUTYRATE
NI, Kosher
Inoue Perfumery
2-METHYLBUTYL BUTYRATE
Jiangyin Healthway
2-Methyl Butyl Butyrate
New functional food ingredients
Jiangyin Healthway
D-2-methyl butyl butyrate
Kingchem Laboratories
2 METHYL BUTYL BUTYRATE
Odor: Fruity, apple odor, somewhat spicy
Kunshan Sainty
2-Methyl Butyl Butyrate, Natural
Lluch Essence
2-METHYL BUTYL BUTYRATE
M&U International
NAT.2-METHYL BUTYL BUTYRATE, Kosher
Moellhausen
2-METHYL BUTYL BUTYRATE
Odor: fruity, slightly buttery, fatty
Penta International
2-METHYLBUTYL BUTYRATE, Kosher
Penta International
2-METHYLBUTYL BUTYRATE, NATURAL, Kosher
SRS Aromatics
METHYL 2 BUTYL BUTYRATE
Sunaux International
nat.2-Methyl Butyl Butyrate
Sunaux International
nat.D-2-Methylbutyl Acetate
 
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
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 2.10 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 3900 (μg/person/day)
Threshold of Concern:1800 (μg/person/day)
Structure Class: I
 
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 7.0000035.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 5.0000025.00000
Edible ices, including sherbet and sorbet (03.0): 10.0000050.00000
Processed fruit (04.1): 7.0000035.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 10.0000050.00000
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 5.0000025.00000
Bakery wares (07.0): 10.0000050.00000
Meat and meat products, including poultry and game (08.0): 2.0000010.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 2.0000010.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 5.0000025.00000
Foodstuffs intended for particular nutritional uses (13.0): 10.0000050.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 5.0000025.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 10.0000050.00000
Ready-to-eat savouries (15.0): 20.00000100.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 5.0000025.00000
 
Safety References:
European Food Safety Athority(efsa):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

European Food Safety Authority (EFSA) reference(s):

Flavouring Group Evaluation 2, Revision 1 (FGE.02) : Branched- and straight-chain aliphatic saturated primary alcohols and related esters of primary alcohols and straight-chain carboxylic acids and one straight-chain aldehyde from chemical groups 1 and 2 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC)
View page or View pdf

EPI System: View
EPA Substance Registry Services (TSCA):51115-64-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :162627
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2-methylbutyl butanoate
Chemidplus:0051115641
 
References:
 2-methylbutyl butanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:51115-64-1
Pubchem (cid):162627
Pubchem (sid):135117343
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:2915.60.0000
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
animal
methyl (E)-2-octenoate
FL/FR
balsamic
cinnamyl benzoate
FL/FR
buttery
acetoin propylene glycol acetal
FL/FR
apple butter fragrance
FR
ethereal
iso
propyl acetate
FL/FR
fatty
7-
decen-4-olide
FL/FR
fermented
hexanal diethyl acetal
FL/FR
floral
benzyl lactate
FL/FR
gamma-
damascone
FR
(Z)-alpha-
damascone
FL/FR
alpha-
damascone
FL/FR
geranium oil egypt fractions
FR
hexyl 2-furoate
FL/FR
methyl citronellate
FL/FR
neryl acetate
FL/FR
fruity
acetaldehyde hexyl isoamyl acetal
FL/FR
allyl propionate
FL/FR
amyl 2-methyl butyrate
FL/FR
amyl acetate
FL/FR
iso
amyl butyrate
FL/FR
amyl isobutyrate
FL/FR
amyl isovalerate
FL/FR
iso
amyl propionate
FL/FR
apple crotonate
FR
apple ketal
FL/FR
benzyl isovalerate
FL/FR
butyl isovalerate
FL/FR
cyclohexyl butyrate
FL/FR
(E)-alpha-
damascone
FL/FR
(S)-delta-
decalactone
FL/FR
eriocephalus punctulatus flower oil
FR
ethyl (E)-2-decenoate
FL/FR
ethyl (E)-4-octenoate
FR
ethyl acetoacetate
FL/FR
ethyl isovalerate
FL/FR
ethyl valerate
FL/FR
fruity ketal
FL/FR
geranyl 2-methyl butyrate
FL/FR
(Z)-3-
hexen-1-yl isobutyrate
FL/FR
hexyl (E)-tiglate
FL/FR
hexyl isovalerate
FL/FR
methyl (Z)-4-decenoate
FL/FR
methyl 2-methyl butyrate
FL/FR
methyl isovalerate
FL/FR
methyl nonanoate
FL/FR
2-
methyl-2-pentenyl acetate
FR
nonyl isovalerate
FL/FR
(Z)-3-
octen-1-yl propionate
FL/FR
iso
propyl 2-methyl butyrate
FL/FR
propyl 2-methyl butyrate
FL/FR
propyl butyrate
FL/FR
propyl heptanoate
FL/FR
propyl isovalerate
FL/FR
iso
propyl isovalerate
FL/FR
strawberry furanone butyrate
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
(E,E)-5,6,7,7-
tetramethyl-2,5-octadien-4-one
FR
green
butyl heptanoate
FL/FR
ethyl (E,Z)-2,4-decadienoate
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 2-methyl butyrate
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl angelate
FR
(E)-2-
hexen-1-yl butyrate
FL/FR
(E)-2-
hexen-1-yl hexanoate
FL/FR
(E)-2-
hexen-1-yl propionate
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
(Z)-3-
hexen-1-yl valerate
FL/FR
(E)-2-
hexen-1-yl valerate
FL/FR
(Z)-3-
hexenal
FL/FR
3-
hexenal
FL/FR
(E)-2-
hexenal propylene glycol acetal
FL/FR
(Z)-3-
hexenyl methyl ether
FR
hexyl 2-methyl butyrate
FL/FR
hexyl butyrate
FL/FR
hexyl isobutyrate
FL/FR
methyl (E)-3-hexenoate
FL/FR
(E,Z)-3,6-
nonadien-1-yl acetate
FL/FR
3,6-
nonadien-1-yl acetate
FL/FR
3-
octyl formate
FL/FR
(E)-2-
pentenal
FL/FR
propyl tiglate
FL/FR
sorbyl isobutyrate
FL/FR
(E,E)-
sorbyl isobutyrate
FL/FR
musk
musk propanoate
FR
soapy
ethyl undecanoate
FL/FR
tropical
ethyl (Z)-3-hexenoate
FL/FR
hexyl 2-methyl-3-pentenoate
FL/FR
waxy
ethyl decanoate
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
woody
lariciu
pine needle oil
FR
For Flavor
No flavor group found for these
acetaldehyde hexyl isoamyl acetal
FL/FR
acetone
FL
allyl cyclohexyl valerate
FL
amyl 2-methyl butyrate
FL/FR
amyl isobutyrate
FL/FR
amyl isovalerate
FL/FR
benzyl lactate
FL/FR
cinnamyl benzoate
FL/FR
cyclohexyl butyrate
FL/FR
(Z)-alpha-
damascone
FL/FR
(S)-delta-
decalactone
FL/FR
9-
decen-2-one
FL
7-
decen-4-olide
FL/FR
ethyl (Z)-3-hexenoate
FL/FR
geranyl 2-methyl butyrate
FL/FR
hexanal diethyl acetal
FL/FR
(E)-3-
hexenal
FL
(E)-2-
hexenal propylene glycol acetal
FL/FR
2-
hexyl acetate
FL
methyl (Z)-4-decenoate
FL/FR
nonyl isovalerate
FL/FR
4,5-
octane dione
FL
propyl 2-methyl butyrate
FL/FR
iso
propyl isovalerate
FL/FR
propyl isovalerate
FL/FR
propyl tiglate
FL/FR
(E,E)-
sorbyl isobutyrate
FL/FR
(E)-2-
tridecen-1-yl acetate
FL/FR
sorbyl isobutyrate
FL/FR
alliaceous
alliaceous
allyl propionate
FL/FR
buttery
acetoin propylene glycol acetal
FL/FR
estery
ethyl acetoacetate
FL/FR
ethereal
iso
propyl acetate
FL/FR
fatty
2,4-
undecadienal
FL
floral
methyl citronellate
FL/FR
neryl acetate
FL/FR
fruity
amyl acetate
FL/FR
iso
amyl propionate
FL/FR
apple ketal
FL/FR
benzyl isovalerate
FL/FR
butyl heptanoate
FL/FR
butyl isovalerate
FL/FR
(E)-alpha-
damascone
FL/FR
alpha-
damascone
FL/FR
ethyl (E)-2-decenoate
FL/FR
ethyl isovalerate
FL/FR
ethyl valerate
FL/FR
fruity ketal
FL/FR
furfuryl valerate
FL
(Z)-3-
hexen-1-yl (E)-2-hexenoate
FL/FR
(Z)-3-
hexen-1-yl isobutyrate
FL/FR
hexyl 2-methyl-3-pentenoate
FL/FR
methyl (E)-2-octenoate
FL/FR
methyl 2-methyl butyrate
FL/FR
methyl isovalerate
FL/FR
(Z)-3-
octen-1-yl propionate
FL/FR
iso
propyl 2-methyl butyrate
FL/FR
propyl butyrate
FL/FR
strawberry furanone butyrate
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
green
ethyl (E,Z)-2,4-decadienoate
FL/FR
green note propionate
FL/FR
heptyl acetate
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 butyrate
FL/FR
(E)-2-
hexen-1-yl hexanoate
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
(Z)-3-
hexenal
FL/FR
3-
hexenal
FL/FR
hexyl (E)-tiglate
FL/FR
hexyl 2-furoate
FL/FR
hexyl 2-methyl butyrate
FL/FR
hexyl butyrate
FL/FR
hexyl isobutyrate
FL/FR
hexyl isovalerate
FL/FR
methyl (E)-3-hexenoate
FL/FR
3,6-
nonadien-1-yl acetate
FL/FR
(E,Z)-3,6-
nonadien-1-yl acetate
FL/FR
(E)-2-
pentenal
FL/FR
herbal
5-
hydroxymethyl furfural
FL
waxy
iso
amyl butyrate
FL/FR
ethyl decanoate
FL/FR
ethyl undecanoate
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
 cananga odorata
Search Trop Picture
 eriocephalus punctulatus flower oil @ 1.00%
Data GC Search Trop Picture
 
Synonyms:
 butanoic acid 2-methylbutyl ester
 butanoic acid, 2-methyl butyl ester
 butanoic acid, 2-methylbutyl ester
 butyric acid 2-methylbutyl ester
2-methyl butyl butanoate
2 methyl butyl butyrate
nat.2-methyl butyl butyrate
2-methyl butyl-N-butyrate
 methyl-2-butyl-butyrate
2-methylbutyl butanoate
2-methylbutyl butyrate
2-methylbutyl butyrate natural
 
 
Notes:
None found
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