7-Ethyl-3,7-Dihydro-6-Methyl-5-Phenylpyrrolo[3,4-e]-1,4-Diazepin-2(1H)-One
[CAS# 57435-92-4]

Identification

• Name: 7-Ethyl-3,7-Dihydro-6-Methyl-5-Phenylpyrrolo[3,4-e]-1,4-Diazepin-2(1H)-One
• Synonyms: 3,7-Dihydro-7-Ethyl-6-Methyl-5-Phenylpyrrolo(3,4-E)(1,4)Diazepin-2(1H)-One; Brn 0619477; Pyrrolo(3,4-E)(1,4)Diazepin-2(1H)-One, 3,7-Dihydro-7-Ethyl-6-Methyl-5-Phenyl-
• Molecular Formula: C₁₆H₁₇N₃O
• Molecular Weight: 267.33
• CAS Registry Number: 57435-92-4
• SMILES: C2=C1NC(=O)CN=C(C1=C([N]2CC)C)C3=CC=CC=C3
• InChI: 1S/C16H17N3O/c1-3-19-10-13-15(11(19)2)16(17-9-14(20)18-13)12-7-5-4-6-8-12/h4-8,10H,3,9H2,1-2H3,(H,18,20)
• InChIKey: ZKBWSUUIPFUHLM-UHFFFAOYSA-N

Properties

• Density: 1.213g/cm³ (Cal.)
• Boiling point: 459.448°C at 760 mmHg (Cal.)
• Flash point: 231.666°C (Cal.)