[[(9-Oxo-9H-Thioxanthen-2-Yl)Methyl]Thio]Acetic Acid
[CAS# 84434-06-0]

Identification

• Name: [[(9-Oxo-9H-Thioxanthen-2-Yl)Methyl]Thio]Acetic Acid
• Synonyms: 2-[(9-Oxo-2-Thioxanthenyl)Methylthio]Acetic Acid; 2-[(9-Ketothioxanthen-2-Yl)Methylthio]Acetic Acid; 2-[(9-Oxothioxanthen-2-Yl)Methylsulfanyl]Ethanoic Acid
• Molecular Formula: C₁₆H₁₂O₃S₂
• Molecular Weight: 316.39
• CAS Registry Number: 84434-06-0
• EINECS: 282-804-3
• SMILES: C1=C(CSCC(=O)O)C=CC2=C1C(=O)C3=C(S2)C=CC=C3
• InChI: 1S/C16H12O3S2/c17-15(18)9-20-8-10-5-6-14-12(7-10)16(19)11-3-1-2-4-13(11)21-14/h1-7H,8-9H2,(H,17,18)
• InChIKey: OAXDQBFKSFMEIN-UHFFFAOYSA-N

Properties

• Density: 1.438g/cm³ (Cal.)
• Boiling point: 552.473°C at 760 mmHg (Cal.)
• Flash point: 287.926°C (Cal.)