ethyl 2-hydroxy-2-methyl butyrate
(+/-)-ethyl 2-hydroxy-2-methylbutyrate
 
Notes:
Used as a food additive [EAFUS]
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CAS Number: 77-70-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 201-050-8
FDA UNII: FGG7G355MX
Nikkaji Web: J192.564D
XlogP3-AA: 0.90 (est)
Molecular Weight: 146.18618000
Formula: C7 H14 O3
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
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JECFA Food Flavoring: 1651  (+/-)-ethyl 2-hydroxy-2-methylbutyrate
FEMA Number: 4268 (+/-)-ethyl 2-hydroxy-2-methylbutyrate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):77-70-3 ; (+/-)-ETHYL 2-HYDROXY-2-METHYLBUTYRATE
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 98.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.96400 to 0.97400 @  25.00 °C.
Pounds per Gallon - (est).: 8.021 to  8.105
Refractive Index: 1.40900 to 1.41600 @  20.00 °C.
Boiling Point: 169.00 to  170.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.505000 mmHg @ 25.00 °C. (est)
Flash Point: 131.00 °F. TCC ( 55.00 °C. )
logP (o/w): 0.881 (est)
Soluble in:
 water, very slightly
 water, 5.705e+004 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 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
(E)-2-hexen-1-yl 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
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Organoleptic Properties:
 
Odor Type: caramellic
 
 caramellic  nutty  
Odor Description:
at 10.00 % in dipropylene glycol. 
caramel nutty
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Axsyn
For experimental / research use only.
Butanoic acid,2-hydroxy-2-methyl-, ethyl ester
Endeavour Specialty Chemicals
Ethyl 2-hydroxy-2-methylbutyrate
Speciality Chemical Product Groups
R C Treatt & Co Ltd
Ethyl 2-hydroxy-2-methylbutyrate
Kosher
Robinson Brothers
Ethyl 2-hydroxy-2-methylbutyrate
https://www.robinsonbrothers.uk/chemistry-competences
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the CSA
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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
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Safety in Use Information:
Category: flavor and fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for ethyl 2-hydroxy-2-methyl butyrate usage levels up to:
  1.0000 % 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
Click here to view publication 23
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): 10.0000025.00000
beverages(alcoholic): 10.0000025.00000
breakfast cereal: 10.0000030.00000
cheese: --
chewing gum: 20.00000100.00000
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 5.0000020.00000
fruit ices: 5.0000020.00000
gelatins / puddings: 10.0000025.00000
granulated sugar: --
gravies: --
hard candy: 20.0000050.00000
imitation dairy: --
instant coffee / tea: 10.0000025.00000
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: 5.0000020.00000
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: 10.0000025.00000
soups: --
sugar substitutes: --
sweet sauces: --
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 77-70-3
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 101536
National Institute of Allergy and Infectious Diseases: Data
 ethyl 2-hydroxy-2-methylbutanoate
Chemidplus: 0000077703
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References:
 ethyl 2-hydroxy-2-methylbutanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 77-70-3
Pubchem (cid): 101536
Pubchem (sid): 135058511
Pherobase: View
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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
FDA Substances Added to Food (formerly EAFUS): View
HMDB (The Human Metabolome Database): HMDB32269
FooDB: FDB009393
Export Tariff Code: 2918.19.9890
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
buttery
 acetoinFL/FR
 caramel furanone solutionFL/FR
 caramel pentadioneFL/FR
 cycloteneFL/FR
 cyclotene hydrateFL/FR
alpha,alpha-dimethyl anisyl acetoneFL/FR
 ethyl cyclopentenoloneFL/FR
 ethyl maltolFL/FR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
 fenugreek absoluteFL/FR
 geranyl crotonateFR
 immortelle absoluteFL/FR
 maltolFL/FR
 maltyl propionateFL/FR
 maple furanoneFL/FR
 menthone lactoneFL/FR
 mesitene lactoneFR
 rosefuranFL/FR
 shoyu furanoneFL/FR
 strawberry furanoneFL/FR
 toffee furanoneFL/FR
coumarinic
 tonka bean resinoidFR
ethereal
isovaleraldehyde propylene glycol acetalFL/FR
 
For Flavor
 
No flavor group found for these
2-acetyl-3,4,5,6-tetrahydropyridineFL
 allyl 2-furoateFL
alpha,alpha-dimethyl anisyl acetoneFL/FR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
 menthone lactoneFL/FR
 rosefuranFL/FR
acidic
dextro,laevo-tartaric acidFL
caramellic
 caramel furanoneFL
 caramel furanone solutionFL/FR
 caramel pentadioneFL/FR
 cycloteneFL/FR
 cyclotene hydrateFL/FR
 ethyl maltolFL/FR
5-ethyl-3,4,5,6-tetramethyl cyclohexen-2-oneFL
 fenugreek absoluteFL/FR
 maltolFL/FR
 maltyl propionateFL/FR
 maple furanoneFL/FR
 shoyu furanoneFL/FR
 strawberry furanoneFL/FR
 toffee furanoneFL/FR
creamy
 acetoinFL/FR
fatty
(E,E)-2,4-undecadienalFL
2,4-undecadienalFL
fruity
2-pentanoyl furanFL
isovaleraldehyde propylene glycol acetalFL/FR
green
 immortelle absoluteFL/FR
jammy
 ethyl cyclopentenoloneFL/FR
sweet
 caramel dioneFL
 
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Potential Uses:
 caramelFL
 nutFL
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Occurrence (nature, food, other): note
 pineapple fruit
Search Trop  Picture
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Synonyms:
 butanoic acid, 2-hydroxy-2-methyl-, ethyl ester
 butanoic acid,2-hydroxy-2-methyl-, ethyl ester
4-ethoxy-2-pyridinecarboxylic acid ethyl ester
(±)-ethyl 2-hydroxy-2-methyl butyrate
 ethyl 2-hydroxy-2-methylbutanoate
 ethyl 2-hydroxy-2-methylbutyrate
(+/-)-ethyl 2-hydroxy-2-methylbutyrate
(±)-ethyl 2-hydroxy-2-methylbutyrate
2-hydroxy-2-methyl butanoic acid ethyl ester
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