5-Pentyl-2-Phenyl-1,2-Dihydro-3H-1,2,4-Triazol-3-One
[CAS# 28669-30-9]

Identification

• Name: 5-Pentyl-2-Phenyl-1,2-Dihydro-3H-1,2,4-Triazol-3-One
• Molecular Formula: C₁₃H₁₇N₃O
• Molecular Weight: 231.29
• CAS Registry Number: 28669-30-9
• SMILES: CCCCCC=1NC(=O)N(N=1)c2ccccc2
• InChI: 1S/C13H17N3O/c1-2-3-5-10-12-14-13(17)16(15-12)11-8-6-4-7-9-11/h4,6-9H,2-3,5,10H2,1H3,(H,14,15,17)
• InChIKey: VFUKZSDILSNJQM-UHFFFAOYSA-N

Properties

• Density: 1.148g/cm³ (Cal.)
• Refractive index: 1.591 (Cal.)