(2E)-2-Butenoic Acid,(3Z)-3-Hexen-1-Yl Ester
[CAS# 65405-80-3]

Identification

• Classification: Flavors and spices >> Synthetic spice >> Carboxylic acid and ester perfume >> Aromatic carboxylic acid ester
• Name: (2E)-2-Butenoic Acid,(3Z)-3-Hexen-1-Yl Ester
• Synonyms: (E)-But-2-Enoic Acid [(E)-Hex-3-Enyl] Ester; Cis-3-Hexenyl Crotonate; Cis-3-Hexenyl Trans-2-Butenoate
• Molecular Formula: C₁₀H₁₆O₂
• Molecular Weight: 168.24
• CAS Registry Number: 65405-80-3
• EINECS: 265-746-3
• SMILES: C(OC(\C=C\C)=O)C\C=C\CC
• InChI: 1S/C10H16O2/c1-3-5-6-7-9-12-10(11)8-4-2/h4-6,8H,3,7,9H2,1-2H3/b6-5+,8-4+
• InChIKey: KITGYVIOYOCIIE-PTFSRLPTSA-N

Properties

• Density: 0.913g/cm³ (Cal.)
• Boiling point: 225.702°C at 760 mmHg (Cal.)
• Flash point: 96.557°C (Cal.)