4-(2,2-Dimethoxyethyl)-5-Phenyl-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione
[CAS# 136745-20-5]

Identification

• Name: 4-(2,2-Dimethoxyethyl)-5-Phenyl-2,4-Dihydro-3H-1,2,4-Triazole-3-Thione
• Synonyms: 4-(2,2-dimethoxyethyl)-5-phenyl-1,2,4-triazole-3-thiol; Maybridge4_004472; ZINC00123920
• Molecular Formula: C₁₂H₁₅N₃O₂S
• Molecular Weight: 265.33
• CAS Registry Number: 136745-20-5
• SMILES: S=C1N(\C(=N/N1)c2ccccc2)CC(OC)OC
• InChI: 1S/C12H15N3O2S/c1-16-10(17-2)8-15-11(13-14-12(15)18)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H,14,18)
• InChIKey: CJEIRWZHMRYHDH-UHFFFAOYSA-N

Properties

• Density: 1.27g/cm³ (Cal.)
• Boiling point: 351.709°C at 760 mmHg (Cal.)
• Flash point: 166.508°C (Cal.)
• Refractive index: 1.611 (Cal.)