Tert-Butyl 8-Chloro-5-Methyl-6-Oxo-4H-Imidazo[1,5-a][1,4]Benzodiazepine-3-Carboxylate
[CAS# 146137-59-9]

Identification

• Name: Tert-Butyl 8-Chloro-5-Methyl-6-Oxo-4H-Imidazo[1,5-a][1,4]Benzodiazepine-3-Carboxylate
• Synonyms: 8-Chloro-5-Methyl-6-Oxo-4H-Imidazo[1,5-A][1,4]Benzodiazepine-3-Carboxylic Acid Tert-Butyl Ester; 8-Chloro-6-Keto-5-Methyl-4H-Imidazo[1,5-A][1,4]Benzodiazepine-3-Carboxylic Acid Tert-Butyl Ester; Zg 63
• Molecular Formula: C₁₇H₁₈ClN₃O₃
• Molecular Weight: 347.80
• CAS Registry Number: 146137-59-9
• SMILES: C1=NC(=C2CN(C)C(C3=C([N]12)C=CC(=C3)Cl)=O)C(=O)OC(C)(C)C
• InChI: 1S/C17H18ClN3O3/c1-17(2,3)24-16(23)14-13-8-20(4)15(22)11-7-10(18)5-6-12(11)21(13)9-19-14/h5-7,9H,8H2,1-4H3
• InChIKey: NLEQOPYBIKKOPK-UHFFFAOYSA-N

Properties

• Density: 1.342g/cm³ (Cal.)
• Boiling point: 552.118°C at 760 mmHg (Cal.)
• Flash point: 287.711°C (Cal.)