3-[4-Oxo-5-(3-Phenyl-Allylidene)-2-Thioxo-Thiazolidin-3-Yl]-Propionic Acid
[CAS# 7025-17-4]

Identification

• Name: 3-[4-Oxo-5-(3-Phenyl-Allylidene)-2-Thioxo-Thiazolidin-3-Yl]-Propionic Acid
• Synonyms: 3-[(5E)-4-Oxo-5-[(E)-3-Phenylprop-2-Enylidene]-2-Thioxo-Thiazolidin-3-Yl]Propanoate; 3-[(5E)-4-Oxo-5-[(E)-3-Phenylprop-2-Enylidene]-2-Thioxo-3-Thiazolidinyl]Propanoate; 3-[(5E)-4-Keto-5-[(E)-3-Phenylprop-2-Enylidene]-2-Thioxo-Thiazolidin-3-Yl]Propionate
• Molecular Formula: C₁₅H₁₂NO₃S₂
• Molecular Weight: 318.38
• CAS Registry Number: 7025-17-4
• SMILES: C2=C(\C=C\C=C/1SC(=S)N(CCC([O-])=O)C1=O)C=CC=C2
• InChI: 1S/C15H13NO3S2/c17-13(18)9-10-16-14(19)12(21-15(16)20)8-4-7-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,17,18)/p-1/b7-4+,12-8+
• InChIKey: FCFWOZQHXOJVMA-HCFISPQYSA-M

Properties

• Boiling point: 528.272°C at 760 mmHg (Cal.)
• Flash point: 273.289°C (Cal.)