ChemSpider 2D Image | 2-(2-Phenyl-2,3-dihydro-1H-1,5-benzodiazepin-4-yl)phenol | C21H18N2O

2-(2-Phenyl-2,3-dihydro-1H-1,5-benzodiazepin-4-yl)phenol

  • Molecular FormulaC21H18N2O
  • Average mass314.380 Da
  • Monoisotopic mass314.141907 Da
  • ChemSpider ID21133159

More details:

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

2-(2-Phenyl-2,3-dihydro-1H-1,5-benzodiazepin-4-yl)phenol [ACD/IUPAC Name]
2-(2-Phenyl-2,3-dihydro-1H-1,5-benzodiazepin-4-yl)phenol [German] [ACD/IUPAC Name]
2-(2-Phényl-2,3-dihydro-1H-1,5-benzodiazépin-4-yl)phénol [French] [ACD/IUPAC Name]
4-(2-hydroxyphenyl)-2-phenyl-2,3-dihydro-1H-1,5-benzodiazepine
Phenol, 2-(2,3-dihydro-2-phenyl-1H-1,5-benzodiazepin-4-yl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 506.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 260.3±30.1 °C
Index of Refraction: 1.651
Molar Refractivity: 96.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 118.49
ACD/KOC (pH 5.5): 776.83
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 285.07
ACD/KOC (pH 7.4): 1869.01
Polar Surface Area: 45 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 263.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement