Heptylbenzoate
[CAS# 7155-12-6]

Identification

• Name: Heptylbenzoate
• Synonyms: Benzoic Acid Heptyl Ester; Nsc53805
• Molecular Formula: C₁₄H₂₀O₂
• Molecular Weight: 220.31
• CAS Registry Number: 7155-12-6
• EINECS: 230-511-6
• SMILES: C1=C(C=CC=C1)C(=O)OCCCCCCC
• InChI: 1S/C14H20O2/c1-2-3-4-5-9-12-16-14(15)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3
• InChIKey: UMFTYCUYCNMERS-UHFFFAOYSA-N

Properties

• Density: 0.973g/cm³ (Cal.)
• Boiling point: 303.946°C at 760 mmHg (Cal.)
• Flash point: 128.104°C (Cal.)