Hexyl 2-methylbutyrate

Hexyl 2-methylbutyrate Basic information
Product Name:Hexyl 2-methylbutyrate
Synonyms:2-Methylbutanoic acid, n-hexyl ester;2-methylbutanoicacid,n-hexylester;2-methyl-butanoicacihexylester;2-methyl-butyricacihexylester;Hexyl 2-methyol buty;Butanoicacid,2-methyl-,hexylester;Butyric acid, 2-methyl-, hexyl ester;n-Hexyl 2-methyl butyrate
CAS:10032-15-2
MF:C11H22O2
MW:186.29
EINECS:233-106-2
Product Categories:Alphabetical Listings;Flavors and Fragrances;G-H
Mol File:10032-15-2.mol
Hexyl 2-methylbutyrate Structure
Hexyl 2-methylbutyrate Chemical Properties
Melting point -63.1°C (estimate)
Boiling point 217-219 °C(lit.)
density 0.857 g/mL at 25 °C(lit.)
FEMA 3499 | HEXYL 2-METHYLBUTANOATE
refractive index n20/D 1.4185(lit.)
Fp 183 °F
form neat
Odorat 100.00 %. green waxy fruity apple spicy tropical
Odor Typegreen
JECFA Number208
LogP4.24
CAS DataBase Reference10032-15-2(CAS DataBase Reference)
NIST Chemistry ReferenceButanoic acid, 2-methyl-, hexyl ester(10032-15-2)
EPA Substance Registry SystemButanoic acid, 2-methyl-, hexyl ester (10032-15-2)
Safety Information
Hazard Codes N
Risk Statements 51/53
Safety Statements 61
RIDADR UN 3077 9/PG 3
WGK Germany 3
RTECS ET5675000
HS Code 29154000
MSDS Information
ProviderLanguage
SigmaAldrich English
Hexyl 2-methylbutyrate Usage And Synthesis
DescriptionHexyl 2-methylbutyrate has a strong, green, fruity odor and a sweet, fruity taste reminiscent of unripe strawberry. May be synthesized by esterification of n-hexanol with 2 -methylbutanoic acid.
Chemical PropertiesHexyl 2-methylbutyrate has a strong, green, fruity odor and a sweet, fruity taste reminiscent of unripe strawberry.
OccurrenceReported found in apple, apricot, sweet cherry, grapes, strawberry, nectarine, banana, mentha oils, white wine, thymus, yellow passion fruit, plum, quince, cherimoya, babaco fruit (Carica pentagona Heilborn), spineless monkey orange and lamb’s lettuce
DefinitionChEBI: Hexyl 2-methylbutanoate is a butyrate ester. It is functionally related to a hexan-1-ol.
PreparationBy esterification of n-hexanol with 2-methylbutanoic acid
Aroma threshold valuesDetection: 22 to 430 ppb
Taste threshold valuesTaste characteristics at 20 ppm: green, waxy, unripe fruity, apple and banana with a fresh, fleshy nuance.
Hexyl 2-methylbutyrate Preparation Products And Raw materials
Raw materials1-Hexanol
Isoamyl butyrate Isoamyl chloroformate Isoamyl nitrite Methyl propiolate Tributyrin Hexyl 2-methylbutyrate DIMETHYL PHOSPHATE Hexyl butyrate 2,2-Bis(hydroxymethyl)butyric acid LACTIC ACID ISOAMYL ESTER 3-Methylbutyl 3-methylbutanoate 2-Methyl butyric acid Dimethyl methylphosphonate Isovaleric acid Isoamyl nitrate γ-Methylbutyl nitrate Di-iso-amyl phthalate HexanitrodiphenylaMine Hexyl isocyanate

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