Hexyl2-methylbutanoate , 98% , 10032-15-2

Synonym(s):
Hexyl 2-methylbutyrate

CAS NO.：10032-15-2

Empirical Formula: C11H22O2

Molecular Weight: 186.29

MDL number: MFCD00048880

EINECS: 233-106-2

PRODUCT Properties

• Melting point: -63.1°C (estimate)
• Boiling point: 217-219 °C(lit.)
• Density: 0.857 g/mL at 25 °C(lit.)
• refractive index: n20/D 1.4185(lit.)
• FEMA: 3499 | HEXYL 2-METHYLBUTANOATE
• Flash point: 183 °F
• Odor: at 100.00 %. green waxy fruity apple spicy tropical
• Odor Type: green
• biological source: synthetic
• JECFA Number: 208
• Major Application: flavors and fragrances
• Cosmetics Ingredients Functions: PERFUMING
• InChI: 1S/C11H22O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h10H,4-9H2,1-3H3
• InChIKey: YUECNVSODFDKOQ-UHFFFAOYSA-N
• SMILES: CCCCCCOC(=O)C(C)CC
• LogP: 4.24
• CAS DataBase Reference: 10032-15-2(CAS DataBase Reference)
• NIST Chemistry Reference: Butanoic acid, 2-methyl-, hexyl ester(10032-15-2)
• EPA Substance Registry System: Butanoic acid, 2-methyl-, hexyl ester (10032-15-2)

Description and Uses

Hexyl 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.

Hexyl 2-methylbutyrate is used as a flavoring agent to blend apple, mint, and pineapple flavorings, and is mainly used to formulate fruit and tobacco flavorings.

Safety

• Symbol(GHS): GHS09
• Signal word: Danger
• Hazard statements: H411
• Precautionary statements: P273
• PPE: Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
• Hazard Codes: N
• Risk Statements: 51/53
• Safety Statements: 61
• RIDADR: UN 3077 9/PG 3
• WGK Germany: 3
• RTECS: ET5675000
• TSCA: TSCA listed
• HS Code: 29154000
• Storage Class: 10 - Combustible liquids
• Hazard Classifications: Aquatic Chronic 2