Isobutyl cinnamate , 99% , 122-67-8

Synonym(s):
2-methylpropyl 3-phenylpropenoate;2-Methylpropyl cinnamate

CAS NO.：122-67-8

Empirical Formula: C13H16O2

Molecular Weight: 204.26

MDL number: MFCD00038289

EINECS: 204-564-0

PRODUCT Properties

• Boiling point: 287 °C (lit.)
• Density: 1 g/mL at 25 °C (lit.)
• FEMA: 2193 | ISOBUTYL CINNAMATE
• refractive index: n20/D 1.54(lit.)
• Flash point: 237 °F
• storage temp.: Sealed in dry,Room Temperature
• Odor: at 100.00 %. sweet balsam fruity like labdanum
• Odor Type: balsamic
• biological source: synthetic
• JECFA Number: 664
• Major Application: flavors and fragrances
• Cosmetics Ingredients Functions: PERFUMING
• InChI: 1S/C13H16O2/c1-11(2)10-15-13(14)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+
• InChIKey: IQZUZPKOFSOVET-CMDGGOBGSA-N
• SMILES: CC(C)COC(=O)\C=C\c1ccccc1
• LogP: 3.830 (est)
• CAS DataBase Reference: 122-67-8(CAS DataBase Reference)
• NIST Chemistry Reference: 2-Propenoic acid, 3-phenyl-, 2-methylpropyl ester(122-67-8)
• EPA Substance Registry System: 2-Propenoic acid, 3-phenyl-, 2-methylpropyl ester (122-67-8)

Description and Uses

Isobutyl cinnamate has a sweet, fruity, balsamic odor and a sweet taste reminiscent of currant. Prepared by heating cinnamyl chloride and isobutyl alcohol.

Perfumery.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H302-H315-H319-H335
• Precautionary statements: P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
• PPE: Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
• WGK Germany: 2
• RTECS: GD9550000
• TSCA: TSCA listed
• Storage Class: 10 - Combustible liquids
• Toxicity: Both the acute oral LD₅₀ value in rats and the acute dermal LD₅₀ value in rabbits exceeded 5 g/kg(Levenstein, 1975).