5,6-Dihydro-4-Methyl-1-Phenyl-4H-[1,2,4]Triazolo[4,3-a][1,5]Benzodiazepine
[CAS# 54028-91-0]

Identification

• Name: 5,6-Dihydro-4-Methyl-1-Phenyl-4H-[1,2,4]Triazolo[4,3-a][1,5]Benzodiazepine
• Synonyms: 4H-S-Triazolo(4,3-A)(1,5)Benzodiazepine, 5,6-Dihydro-4-Methyl-1-Phenyl-; 5,6-Dihydro-4-Methyl-1-Phenyl-4H-S-Triazolo(4,3-A)(1,5)Benzodiazepine; Brn 1221560
• Molecular Formula: C₁₇H₁₆N₄
• Molecular Weight: 276.34
• CAS Registry Number: 54028-91-0
• SMILES: C4=C3[N]1C(=NN=C1C2=CC=CC=C2)C(CNC3=CC=C4)C
• InChI: 1S/C17H16N4/c1-12-11-18-14-9-5-6-10-15(14)21-16(12)19-20-17(21)13-7-3-2-4-8-13/h2-10,12,18H,11H2,1H3
• InChIKey: WAWZZDHGRORXMH-UHFFFAOYSA-N

Properties

• Density: 1.278g/cm³ (Cal.)
• Boiling point: 512.099°C at 760 mmHg (Cal.)
• Flash point: 263.508°C (Cal.)