1-((Phenylmethyl)thio)-Cyclohexaneacetic acid
[CAS# 55154-80-8]

Identification

• Name: 1-((Phenylmethyl)thio)-Cyclohexaneacetic acid
• Synonyms: 2-[1-(Phenylmethylthio)Cyclohexyl]Acetic Acid; 2-[1-(Benzylthio)Cyclohexyl]Acetic Acid; 2-[1-(Phenylmethylsulfanyl)Cyclohexyl]Ethanoic Acid
• Molecular Formula: C₁₅H₂₀O₂S
• Molecular Weight: 264.38
• CAS Registry Number: 55154-80-8
• SMILES: C1=CC=CC=C1CSC2(CCCCC2)CC(=O)O
• InChI: 1S/C15H20O2S/c16-14(17)11-15(9-5-2-6-10-15)18-12-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12H2,(H,16,17)
• InChIKey: ANTCXHQXYRYSLK-UHFFFAOYSA-N

Properties

• Density: 1.16g/cm³ (Cal.)
• Boiling point: 430.018°C at 760 mmHg (Cal.)
• Flash point: 213.867°C (Cal.)