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51753-57-2

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Basic Information
CAS No.: 51753-57-2
Name: 7-Bromo-5-(2-chlorophenyl)-1,3-dihydro-2H-1,4-Benzodiazepin-2-one
Article Data: 3
Molecular Structure:
Molecular Structure of 51753-57-2 (7-Bromo-5-(2-chlorophenyl)-1,3-dihydro-2H-1,4-Benzodiazepin-2-one)
Formula: C15H10BrClN2O
Molecular Weight: 349.614
Synonyms: 7-Bromo-5-(2-chlorophenyl)-1,3-dihydrobenzo[e]-1,4-diazepin-2-one;BD 98;Fenazepam;
EINECS: 200-835-2
Density: 1.61 g/cm3
Melting Point: 225-230oC
Boiling Point: 493 °C at 760 mmHg
Flash Point: 251.9 °C
Solubility: soluble in water and ether, micro-soluble in 95% ethanol, dissolved in chloroform. 0.1 grams of samples dissolved in 5 ml chloroform
Appearance: White or off-white crystalline powder
Hazard Symbols: F,Xn
Risk Codes: 11-20/21/22-36
Safety: 16-36/37
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Chemistry

IUPAC Name: 7-bromo-5-(2-chlorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one   
Synonyms of Phenazepam (CAS NO.51753-57-2): 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-bromo-5-(2-chlorophenyl)- ; Fenazepam ; Phenazepam
CAS NO: 51753-57-2
Molecular Formula: C15H10BrClN2O
Molecular Weight: 349.609
Molecular Structure:
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 32.67 Å2
Index of Refraction: 1.691
Molar Refractivity: 83.14 cm3
Molar Volume: 217.1 cm3
Surface Tension: 53.2 dyne/cm
Density: 1.61 g/cm3
Flash Point: 251.9 °C
Enthalpy of Vaporization: 76 kJ/mol
Boiling Point: 493 °C at 760 mmHg
Vapour Pressure: 7.32E-10 mmHg at 25°C
SMILES: Clc3ccccc3C/2=N/CC(=O)Nc1c\2cc(Br)cc1
InChI: InChI=1/C15H10BrClN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)
InChIKey: CGMJQQJSWIRRRL-UHFFFAOYAF
Std. InChI: InChI=1S/C15H10BrClN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)
Std. InChIKey: CGMJQQJSWIRRRL-UHFFFAOYSA-N
Product Categories of Phenazepam (CAS NO.51753-57-2): Aromatics;Heterocycles;Intermediates & Fine Chemicals;Pharmaceuticals

Uses

 Phenazepam is a benzodiazepine drug, which is used in the treatment of neurological disorders such as epilepsy, alcohol withdrawal syndrome and insomnia. Besides, Phenazepam can be still used as a premedication before surgery as it enhance the effects of anesthetics and reduces anxiety.

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 620mg/kg (620mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 13(10), Pg. 108, 1979.
mouse LD50 oral 2400mg/kg (2400mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 13(10), Pg. 108, 1979.
rat LD50 intraperitoneal 720mg/kg (720mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 13(10), Pg. 108, 1979.

Safety Profile

Moderately toxic by ingestion and intraperitoneal routes. Experimental reproductive effects. When heated to decomposition it emits toxic fumes of Cl, Br, and NOx.

Specification

Side effects of Phenazepam (CAS NO.51753-57-2): 
Phenazepam cause such side effects as follows: dizziness, loss of coordination and drowsiness, along with anterograde amnesia which can be quite pronounced at high doses. As with other benzodiazepines, in case of abrupt discontinuation following prolonged use, severe withdrawal symptoms may occur, such as restlessness, anxiety, insomnia and convulsions.