Bensuldazic Acid
[CAS# 1219-77-8]

Identification

• Name: Bensuldazic Acid
• Synonyms: 2-[5-(Phenylmethyl)-6-Thioxo-1,3,5-Thiadiazinan-3-Yl]Acetic Acid; 2-[5-(Benzyl)-6-Thioxo-1,3,5-Thiadiazinan-3-Yl]Acetic Acid; 2-[5-(Phenylmethyl)-6-Sulfanylidene-1,3,5-Thiadiazinan-3-Yl]Ethanoic Acid
• Molecular Formula: C₁₂H₁₄N₂O₂S₂
• Molecular Weight: 282.37
• CAS Registry Number: 1219-77-8
• SMILES: C2=C(CN1CN(CSC1=S)CC(O)=O)C=CC=C2
• InChI: 1S/C12H14N2O2S2/c15-11(16)7-13-8-14(12(17)18-9-13)6-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,15,16)
• InChIKey: TUMWSYRTKGBCAG-UHFFFAOYSA-N

Properties

• Density: 1.435g/cm³ (Cal.)
• Boiling point: 472.283°C at 760 mmHg (Cal.)
• Flash point: 239.428°C (Cal.)