3-[(1-Methylethyl)Thio]-1H-1,2,4-Triazole
[CAS# 71705-08-3]

Identification

• Name: 3-[(1-Methylethyl)Thio]-1H-1,2,4-Triazole
• Synonyms: 3-Isopropylsulfanyl-2H-1,2,4-Triazole; 3-(Isopropylthio)-2H-1,2,4-Triazole; Nsc326136
• Molecular Formula: C₅H₉N₃S
• Molecular Weight: 143.21
• CAS Registry Number: 71705-08-3
• SMILES: C1=N[NH]C(=N1)SC(C)C
• InChI: 1S/C5H9N3S/c1-4(2)9-5-6-3-7-8-5/h3-4H,1-2H3,(H,6,7,8)
• InChIKey: JJIZGNFGZUZSNN-UHFFFAOYSA-N

Properties

• Density: 1.201g/cm³ (Cal.)
• Boiling point: 290.865°C at 760 mmHg (Cal.)
• Flash point: 129.711°C (Cal.)