3-Hydroxy-3-(2-Phenylethyl)Hexanoic Acid
[CAS# 215316-59-9]

Identification

• Name: 3-Hydroxy-3-(2-Phenylethyl)Hexanoic Acid
• Synonyms: BENZENEPENTANOIC ACID, B-HYDROXY-B-PROPYL-, (BR)-
• Molecular Formula: C₁₄H₂₀O₃
• Molecular Weight: 236.31
• CAS Registry Number: 215316-59-9
• SMILES: O=C(O)CC(O)(CCc1ccccc1)CCC
• InChI: 1S/C14H20O3/c1-2-9-14(17,11-13(15)16)10-8-12-6-4-3-5-7-12/h3-7,17H,2,8-11H2,1H3,(H,15,16)
• InChIKey: QUCVMTKZXVHNNT-UHFFFAOYSA-N

Properties

• Density: 1.107g/cm³ (Cal.)
• Boiling point: 415.997°C at 760 mmHg (Cal.)
• Flash point: 219.538°C (Cal.)
• Refractive index: 1.537 (Cal.)