[3-(2-Furyl)-5-Thioxo-1,5-Dihydro-4H-1,2,4-Triazol-4-Yl]Acetic Acid
[CAS# 110167-66-3]

Identification

• Name: [3-(2-Furyl)-5-Thioxo-1,5-Dihydro-4H-1,2,4-Triazol-4-Yl]Acetic Acid
• Molecular Formula: C₈H₇N₃O₃S
• Molecular Weight: 225.22
• CAS Registry Number: 110167-66-3
• SMILES: OC(=O)CN2C(=S)N\N=C2\c1ccco1
• InChI: 1S/C8H7N3O3S/c12-6(13)4-11-7(9-10-8(11)15)5-2-1-3-14-5/h1-3H,4H2,(H,10,15)(H,12,13)
• InChIKey: CCEBIFFCYWPJFW-UHFFFAOYSA-N

Properties

• Density: 1.676g/cm³ (Cal.)
• Boiling point: 382.238°C at 760 mmHg (Cal.)
• Flash point: 184.971°C (Cal.)
• Refractive index: 1.751 (Cal.)