2-[(Phenylsulfinyl)Methyl]Benzoic Acid
[CAS# 25562-83-8]

Identification

• Name: 2-[(Phenylsulfinyl)Methyl]Benzoic Acid
• Synonyms: 2-[(PHENYLSULFINYL)METHYL]BENZOICACID; CDS1_000983
• Molecular Formula: C₁₄H₁₂O₃S
• Molecular Weight: 260.31
• CAS Registry Number: 25562-83-8
• SMILES: O=S(c1ccccc1)Cc2ccccc2C(=O)O
• InChI: 1S/C14H12O3S/c15-14(16)13-9-5-4-6-11(13)10-18(17)12-7-2-1-3-8-12/h1-9H,10H2,(H,15,16)
• InChIKey: NNURJXUOUNBQCY-UHFFFAOYSA-N

Properties

• Density: 1.386g/cm³ (Cal.)
• Boiling point: 501.021°C at 760 mmHg (Cal.)
• Flash point: 256.809°C (Cal.)
• Refractive index: 1.683 (Cal.)