3-Phenylpropyl Octanoate
[CAS# 68141-25-3]

Identification

• Name: 3-Phenylpropyl Octanoate
• Synonyms: Octanoic Acid 3-Phenylpropyl Ester; Caprylic Acid 3-Phenylpropyl Ester; 3-Phenylpropyl Caprylate
• Molecular Formula: C₁₇H₂₆O₂
• Molecular Weight: 262.39
• CAS Registry Number: 68141-25-3
• EINECS: 268-848-6
• SMILES: C1=CC=C(C=C1)CCCOC(=O)CCCCCCC
• InChI: 1S/C17H26O2/c1-2-3-4-5-9-14-17(18)19-15-10-13-16-11-7-6-8-12-16/h6-8,11-12H,2-5,9-10,13-15H2,1H3
• InChIKey: OZLRQNRZFQXBQQ-UHFFFAOYSA-N

Properties

• Density: 0.957g/cm³ (Cal.)
• Boiling point: 361.147°C at 760 mmHg (Cal.)
• Flash point: 119.885°C (Cal.)