5,6-Dihydro-1-Phenyl-4H-[1,2,4]Triazolo[4,3-a][1,5]Benzodiazepine
[CAS# 54028-94-3]

Identification

• Name: 5,6-Dihydro-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-1-Phenyl-; 5,6-Dihydro-1-Phenyl-4H-S-Triazolo(4,3-A)(1,5)Benzodiazepine; Brn 1220491
• Molecular Formula: C₁₆H₁₄N₄
• Molecular Weight: 262.31
• CAS Registry Number: 54028-94-3
• SMILES: C3=C2[N]1C(=NN=C1CCNC2=CC=C3)C4=CC=CC=C4
• InChI: 1S/C16H14N4/c1-2-6-12(7-3-1)16-19-18-15-10-11-17-13-8-4-5-9-14(13)20(15)16/h1-9,17H,10-11H2
• InChIKey: MTDDFOLAUQMXBH-UHFFFAOYSA-N

Properties

• Density: 1.305g/cm³ (Cal.)
• Boiling point: 515.591°C at 760 mmHg (Cal.)
• Flash point: 265.62°C (Cal.)