2-[3-[4-(Methylthio)Benzoyl]Phenyl]Propionic Acid
[CAS# 94292-03-2]

Identification

• Name: 2-[3-[4-(Methylthio)Benzoyl]Phenyl]Propionic Acid
• Synonyms: 2-[3-[[4-(Methylthio)Phenyl]-Oxomethyl]Phenyl]Propanoic Acid; 2-[3-[4-(Methylthio)Benzoyl]Phenyl]Propionic Acid; 2-[3-(4-Methylsulfanylphenyl)Carbonylphenyl]Propanoic Acid
• Molecular Formula: C₁₇H₁₆O₃S
• Molecular Weight: 300.37
• CAS Registry Number: 94292-03-2
• EINECS: 304-932-1
• SMILES: C1=C(C(C(=O)O)C)C=CC=C1C(=O)C2=CC=C(SC)C=C2
• InChI: 1S/C17H16O3S/c1-11(17(19)20)13-4-3-5-14(10-13)16(18)12-6-8-15(21-2)9-7-12/h3-11H,1-2H3,(H,19,20)
• InChIKey: UFDXUEHTMZBRTA-UHFFFAOYSA-N

Properties

• Density: 1.265g/cm³ (Cal.)
• Boiling point: 493.299°C at 760 mmHg (Cal.)
• Flash point: 252.138°C (Cal.)