4-[(Phenylthioxomethyl)Thio]Butyric Acid
[CAS# 56666-66-1]

Identification

• Name: 4-[(Phenylthioxomethyl)Thio]Butyric Acid
• Synonyms: 4-[(Phenyl-Thioxomethyl)Thio]Butanoic Acid; 4-(Thiobenzoylthio)Butyric Acid; 4-Phenylcarbothioylsulfanylbutanoic Acid
• Molecular Formula: C₁₁H₁₂O₂S₂
• Molecular Weight: 240.33
• CAS Registry Number: 56666-66-1
• SMILES: C1=CC=CC=C1C(=S)SCCCC(=O)O
• InChI: 1S/C11H12O2S2/c12-10(13)7-4-8-15-11(14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,13)
• InChIKey: QJMYDXDEXVMNKU-UHFFFAOYSA-N

Properties

• Density: 1.286g/cm³ (Cal.)
• Boiling point: 419.223°C at 760 mmHg (Cal.)
• Flash point: 207.339°C (Cal.)