(5-Benzylidene-4-Oxo-2-Thioxo-Thiazolidin-3-Yl)-Acetic Acid
[CAS# 82159-06-6]

Identification

• Name: (5-Benzylidene-4-Oxo-2-Thioxo-Thiazolidin-3-Yl)-Acetic Acid
• Synonyms: 2-[(5Z)-5-(Cyclohexylmethylene)-4-Oxo-2-Thioxo-Thiazolidin-3-Yl]Acetate; 2-[(5Z)-5-(Cyclohexylmethylene)-4-Oxo-2-Thioxo-3-Thiazolidinyl]Acetate; 2-[(5Z)-5-(Cyclohexylmethylene)-4-Keto-2-Thioxo-Thiazolidin-3-Yl]Acetate
• Molecular Formula: C₁₂H₁₄NO₃S₂
• Molecular Weight: 284.37
• CAS Registry Number: 82159-06-6
• SMILES: C(N1C(=O)/C(SC1=S)=C/C2CCCCC2)C([O-])=O
• InChI: 1S/C12H15NO3S2/c14-10(15)7-13-11(16)9(18-12(13)17)6-8-4-2-1-3-5-8/h6,8H,1-5,7H2,(H,14,15)/p-1/b9-6-
• InChIKey: FHLRNSGEEVLDKL-TWGQIWQCSA-M

Properties

• Boiling point: 460.412°C at 760 mmHg (Cal.)
• Flash point: 232.249°C (Cal.)