Methyl 3-amino-5-(methylsulfanyl)-4H-1,2,4-triazole-4-carboxylate
[CAS# 79741-99-4]

Identification

• Name: Methyl 3-amino-5-(methylsulfanyl)-4H-1,2,4-triazole-4-carboxylate
• Synonyms: methyl 3-amino-5-(methylthio)-4H-1,2,4-triazole-4-carboxylate
• Molecular Formula: C₅H₈N₄O₂S
• Molecular Weight: 188.21
• CAS Registry Number: 79741-99-4
• SMILES: COC(=O)n1c(nnc1SC)N
• InChI: 1S/C5H8N4O2S/c1-11-5(10)9-3(6)7-8-4(9)12-2/h1-2H3,(H2,6,7)
• InChIKey: ZHAOWLUAOQBDIG-UHFFFAOYSA-N

Properties

• Density: 1.594g/cm³ (Cal.)
• Boiling point: 395.591°C at 760 mmHg (Cal.)
• Flash point: 193.047°C (Cal.)