Basic information
- Name:
2H-1,4-Benzodiazepin-2-one,3-(acetyloxy)-7-chloro-5-(2-chlorophenyl)-1,3-dihydro-
- Superlist Name:
- 3-(Acetyloxy)-7-chloro-5-(2-chlorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one
- CAS No.:
2848-96-6
- Molecular Structure:
- Formula:
- C17H12Cl2N2O3
- Molecular Weight:
- 363.1948
- Synonyms:
- 2H-1,4-Benzodiazepin-2-one,7-chloro-5-(o-chlorophenyl)-1,3-dihydro-3-hydroxy-, acetate (7CI);2H-1,4-Benzodiazepin-2-one, 7-chloro-5-(o-chlorophenyl)-1,3-dihydro-3-hydroxy-,acetate (ester) (8CI);3-Acetoxy-7-chloro-5-(o-chlorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one;Lorazepam acetate;Ro 7-8407;
- EINECS:
- 220-653-7
- Density:
- 1.45 g/cm3
- Boiling Point:
- 524.4 °C at 760 mmHg
- Flash Point:
- 270.9 °C
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Specification
The 3-(Acetyloxy)-7-chloro-5-(2-chlorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one, its cas register number is 2848-96-6. It also can be called as 7-Chloro-5-(2-chlorophenyl)-1,3-dihydro-2-oxo-2H-1,4-benzodiazepin-3-yl acetate and the IUPAC name about this chemical is [7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]
acetate.
Physical properties about 3-(Acetyloxy)-7-chloro-5-(2-chlorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one are: (1)#H bond acceptors: 5; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 58.97Å2; (5)Index of Refraction: 1.656; (6)Molar Refractivity: 91.46 cm3; (7)Molar Volume: 248.9 cm3; (8)Polarizability: 36.25x10-24cm3; (9)Surface Tension: 51.4 dyne/cm; (10)Enthalpy of Vaporization: 79.83 kJ/mol; (11)Vapour Pressure: 4.33E-11 mmHg at 25°C
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)OC1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3Cl
(2)InChI: InChI=1S/C17H12Cl2N2O3/c1-9(22)24-17-16(23)20-14-7-6-10(18)8-12(14)15(21-17)11-4-2-3-5-13(11)19/h2-8,17H,1H3,(H,20,23)
(3)InChIKey: CYDZMDOLVUBPNL-UHFFFAOYSA-N
