4,5-Diisopropyl-4H-1,2,4-triazole-3-thiol
[CAS# 667437-59-4]

Identification

• Name: 4,5-Diisopropyl-4H-1,2,4-triazole-3-thiol
• Synonyms: 4,5-bis(methylethyl)-1,2,4-triazole-3-thiol; 4,5-Diisopropyl-4H-1,2,4-triazole-3-thiol; MFCD03423414
• Molecular Formula: C₈H₁₅N₃S
• Molecular Weight: 185.29
• CAS Registry Number: 667437-59-4
• SMILES: CC(C)C1=NN=C(N1C(C)C)S
• InChI: 1S/C8H15N3S/c1-5(2)7-9-10-8(12)11(7)6(3)4/h5-6H,1-4H3,(H,10,12)
• InChIKey: FJQNXXMGQSTKBB-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 301.2±25.0°C at 760 mmHg (Cal.)
• Flash point: 136.0±23.2°C (Cal.)
• Refractive index: 1.592 (Cal.)

Safety Data

• Safety Description: IRRITANT