6-Methylheptyl Benzoate
[CAS# 68109-80-8]

Identification

• Name: 6-Methylheptyl Benzoate
• Synonyms: Benzoic Acid 6-Methylheptyl Ester; 1-Heptanol, 6-Methyl-, Benzoate
• Molecular Formula: C₁₅H₂₂O₂
• Molecular Weight: 234.34
• CAS Registry Number: 68109-80-8
• EINECS: 268-491-6
• SMILES: C1=CC=C(C=C1)C(=O)OCCCCCC(C)C
• InChI: 1S/C15H22O2/c1-13(2)9-5-4-8-12-17-15(16)14-10-6-3-7-11-14/h3,6-7,10-11,13H,4-5,8-9,12H2,1-2H3
• InChIKey: ONAJCHYEVMVJQN-UHFFFAOYSA-N

Properties

• Density: 0.963g/cm³ (Cal.)
• Boiling point: 313.101°C at 760 mmHg (Cal.)
• Flash point: 131.998°C (Cal.)