5,9,10,14b-Tetrahydro-2-Chloro-5-(Hydroxymethyl)Isoquino[2,1-d][1,4]Benzodiazepin-6(7H)-One Acetate
[CAS# 67239-20-7]

Identification

• Name: 5,9,10,14b-Tetrahydro-2-Chloro-5-(Hydroxymethyl)Isoquino[2,1-d][1,4]Benzodiazepin-6(7H)-One Acetate
• Synonyms: Isoquino(2,1-D)(1,4)Benzodiazepin-6(7H)-One, 5,9,10,14B-Tetrahydro-2-Chloro-5(Hydroxymethyl)-, Acetate (Ester)
• Molecular Formula: C₂₀H₁₉ClN₂O₃
• Molecular Weight: 370.83
• CAS Registry Number: 67239-20-7
• SMILES: C1=C(Cl)C=CC2=C1C3N(CC(=O)N2COC(=O)C)CCC4=C3C=CC=C4
• InChI: 1S/C20H19ClN2O3/c1-13(24)26-12-23-18-7-6-15(21)10-17(18)20-16-5-3-2-4-14(16)8-9-22(20)11-19(23)25/h2-7,10,20H,8-9,11-12H2,1H3
• InChIKey: APVGECULNCDJCE-UHFFFAOYSA-N

Properties

• Density: 1.389g/cm³ (Cal.)
• Boiling point: 555.291°C at 760 mmHg (Cal.)
• Flash point: 289.63°C (Cal.)