ChemSpider 2D Image | (5R,10bR)-7,9-Dibromo-2-(4-chlorophenyl)-5-(2-furyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine | C20H13Br2ClN2O2

(5R,10bR)-7,9-Dibromo-2-(4-chlorophenyl)-5-(2-furyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine

  • Molecular FormulaC20H13Br2ClN2O2
  • Average mass508.590 Da
  • Monoisotopic mass505.903229 Da
  • ChemSpider ID62579200

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(5R,10bR)-7,9-Dibrom-2-(4-chlorphenyl)-5-(2-furyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin [German] [ACD/IUPAC Name]
(5R,10bR)-7,9-Dibromo-2-(4-chlorophenyl)-5-(2-furyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine [ACD/IUPAC Name]
(5R,10bR)-7,9-Dibromo-2-(4-chlorophényl)-5-(2-furyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine [French] [ACD/IUPAC Name]
5H-Pyrazolo[1,5-c][1,3]benzoxazine, 7,9-dibromo-2-(4-chlorophenyl)-5-(2-furanyl)-1,10b-dihydro-, (5R,10bR)- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 555.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.6±3.0 kJ/mol
Flash Point: 289.5±32.9 °C
Index of Refraction: 1.746
Molar Refractivity: 111.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 5.47
ACD/BCF (pH 5.5): 8379.93
ACD/KOC (pH 5.5): 22365.91
ACD/LogD (pH 7.4): 5.47
ACD/BCF (pH 7.4): 8397.35
ACD/KOC (pH 7.4): 22412.39
Polar Surface Area: 38 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 58.7±7.0 dyne/cm
Molar Volume: 274.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement