ChemSpider 2D Image | (R)-Metaclazepam | C18H18BrClN2O

(R)-Metaclazepam

  • Molecular FormulaC18H18BrClN2O
  • Average mass393.705 Da
  • Monoisotopic mass392.029083 Da
  • ChemSpider ID34989551

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(R)-Metaclazepam
(2R)-7-Brom-5-(2-chlorphenyl)-2-(methoxymethyl)-1-methyl-2,3-dihydro-1H-1,4-benzodiazepin [German] [ACD/IUPAC Name]
(2R)-7-Bromo-5-(2-chlorophenyl)-2-(methoxymethyl)-1-methyl-2,3-dihydro-1H-1,4-benzodiazepine [ACD/IUPAC Name]
(2R)-7-Bromo-5-(2-chlorophényl)-2-(méthoxyméthyl)-1-méthyl-2,3-dihydro-1H-1,4-benzodiazépine [French] [ACD/IUPAC Name]
1H-1,4-Benzodiazepine, 7-bromo-5-(2-chlorophenyl)-2,3-dihydro-2-(methoxymethyl)-1-methyl-, (2R)- [ACD/Index Name]
metaclazepam [INN]
84031-17-4 [RN]
UNII-C2N2B1303L

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 472.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 239.5±28.7 °C
Index of Refraction: 1.620
Molar Refractivity: 98.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 4.35
ACD/BCF (pH 5.5): 1178.83
ACD/KOC (pH 5.5): 5420.90
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 1237.49
ACD/KOC (pH 7.4): 5690.65
Polar Surface Area: 25 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 43.3±7.0 dyne/cm
Molar Volume: 278.9±7.0 cm3

Click to predict properties on the Chemicalize site


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