3-Fluoro-1-Methyl-5-(Methylsulfanyl)-1H-1,2,4-Triazole
[CAS# 214540-57-5]

Identification

• Name: 3-Fluoro-1-Methyl-5-(Methylsulfanyl)-1H-1,2,4-Triazole
• Synonyms: 3-fluoro-1-methyl-5-(methylthio)-1H-1,2,4-triazole
• Molecular Formula: C₄H₆FN₃S
• Molecular Weight: 147.17
• CAS Registry Number: 214540-57-5
• SMILES: Cn1c(nc(n1)F)SC
• InChI: 1S/C4H6FN3S/c1-8-4(9-2)6-3(5)7-8/h1-2H3
• InChIKey: KBKQXTOALDRKLY-UHFFFAOYSA-N

Properties

• Density: 1.414g/cm³ (Cal.)
• Boiling point: 290.053°C at 760 mmHg (Cal.)
• Flash point: 129.22°C (Cal.)
• Refractive index: 1.604 (Cal.)