5-(3-Methoxyphenyl)-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione
[CAS# 419540-45-7]

Identification

• Classification: Chemical reagent >> Organic reagent >> Thiol salt
• Name: 5-(3-Methoxyphenyl)-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione
• Synonyms: 3H-1,2,4-triazole-3-thione, 2,4-dihydro-5-(3-methoxyphenyl); 3H-1,2,4-triazole-3-thione, 2,4-dihydro-5-(3-methoxyphenyl)-; 5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
• Molecular Formula: C₉H₉N₃OS
• Molecular Weight: 207.25
• CAS Registry Number: 419540-45-7
• SMILES: COC1=CC=CC(=C1)C2=NNC(=S)N2
• InChI: 1S/C9H9N3OS/c1-13-7-4-2-3-6(5-7)8-10-9(14)12-11-8/h2-5H,1H3,(H2,10,11,12,14)
• InChIKey: RTTMZCCBDAJGRW-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 318.6±44.0°C at 760 mmHg (Cal.)
• Flash point: 146.5±28.4°C (Cal.)
• Refractive index: 1.685 (Cal.)

Safety Data

• Safety Description: IRRITANT