5-(3-Methylphenyl)-4H-1,2,4-triazole-3-thiol
[CAS# 75218-27-8]

Identification

• Name: 5-(3-Methylphenyl)-4H-1,2,4-triazole-3-thiol
• Synonyms: 3-(3-methylphenyl)-1,2,4-triazoline-5-thione; 4H-1,2,4-triazole-3-thiol, 5-(3-methylphenyl); 5-(3-Methylphenyl)-1,2-dihydro-3H-1,2,4-triazole-3-thione
• Molecular Formula: C₉H₉N₃S
• Molecular Weight: 191.25
• CAS Registry Number: 75218-27-8
• SMILES: CC1=CC(=CC=C1)C2=NN=C(N2)S
• InChI: 1S/C9H9N3S/c1-6-3-2-4-7(5-6)8-10-9(13)12-11-8/h2-5H,1H3,(H2,10,11,12,13)
• InChIKey: GKJMGRNQNUBUMM-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 399.8±35.0°C at 760 mmHg (Cal.)
• Flash point: 195.6±25.9°C (Cal.)

Safety Data

• Safety Description: IRRITANT