3-[[5-[3-Allyl-4-Oxo-2-Thioxothiazolidin-5-Ylidene]-4,5-Dihydro-4-Methyl-1,3,4-Thiadiazol-2-Yl]Thio]Propionic Acid
[CAS# 24075-57-8]

Identification

• Name: 3-[[5-[3-Allyl-4-Oxo-2-Thioxothiazolidin-5-Ylidene]-4,5-Dihydro-4-Methyl-1,3,4-Thiadiazol-2-Yl]Thio]Propionic Acid
• Synonyms: 3-[[(5Z)-5-(3-Allyl-4-Oxo-2-Thioxo-Thiazolidin-5-Ylidene)-4-Methyl-1,3,4-Thiadiazol-2-Yl]Sulfanyl]Propanoic Acid; 3-[[(5Z)-5-(3-Allyl-4-Oxo-2-Thioxo-5-Thiazolidinylidene)-4-Methyl-1,3,4-Thiadiazol-2-Yl]Thio]Propanoic Acid; 3-[[(5Z)-5-(3-Allyl-4-Keto-2-Thioxo-Thiazolidin-5-Ylidene)-4-Methyl-1,3,4-Thiadiazol-2-Yl]Thio]Propionic Acid
• Molecular Formula: C₁₂H₁₃N₃O₃S₄
• Molecular Weight: 375.49
• CAS Registry Number: 24075-57-8
• EINECS: 246-007-4
• SMILES: C(N1C(=O)\C(SC1=S)=C/2SC(=NN2C)SCCC(=O)O)C=C
• InChI: 1S/C12H13N3O3S4/c1-3-5-15-9(18)8(21-12(15)19)10-14(2)13-11(22-10)20-6-4-7(16)17/h3H,1,4-6H2,2H3,(H,16,17)/b10-8-
• InChIKey: BWPACKUSUFELQM-NTMALXAHSA-N

Properties

• Density: 1.582g/cm³ (Cal.)
• Boiling point: 466.983°C at 760 mmHg (Cal.)
• Flash point: 236.223°C (Cal.)