(E)-Hept-2-Enyl Isovalerate
[CAS# 94109-97-4]

Identification

• Name: (E)-Hept-2-Enyl Isovalerate
• Synonyms: 3-Methylbutanoic Acid [(E)-Hept-2-Enyl] Ester; 3-Methylbutyric Acid [(E)-Hept-2-Enyl] Ester; (E)-Hept-2-Enyl Isovalerate
• Molecular Formula: C₁₂H₂₂O₂
• Molecular Weight: 198.30
• CAS Registry Number: 94109-97-4
• EINECS: 302-537-9
• SMILES: C(C(OC\C=C\CCCC)=O)C(C)C
• InChI: 1S/C12H22O2/c1-4-5-6-7-8-9-14-12(13)10-11(2)3/h7-8,11H,4-6,9-10H2,1-3H3/b8-7+
• InChIKey: ACRNCNWXWBBKGP-BQYQJAHWSA-N

Properties

• Density: 0.885g/cm³ (Cal.)
• Boiling point: 250.924°C at 760 mmHg (Cal.)
• Flash point: 83.022°C (Cal.)