ChemSpider 2D Image | N-(4-Bromophenyl)abieta-8,11,13-trien-18-amide | C26H32BrNO

N-(4-Bromophenyl)abieta-8,11,13-trien-18-amide

  • Molecular FormulaC26H32BrNO
  • Average mass454.442 Da
  • Monoisotopic mass453.166718 Da
  • ChemSpider ID24743939

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-Phenanthrenecarboxamide, N-(4-bromophenyl)-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)- [ACD/Index Name]
N-(4-Bromophenyl)abieta-8,11,13-trien-18-amide [ACD/IUPAC Name]
N-(4-Bromophényl)abiéta-8,11,13-trién-18-amide [French] [ACD/IUPAC Name]
N-(4-Bromphenyl)abieta-8,11,13-trien-18-amid [German] [ACD/IUPAC 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: 565.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.9±30.1 °C
Index of Refraction: 1.595
Molar Refractivity: 124.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 8.92
ACD/LogD (pH 5.5): 7.86
ACD/BCF (pH 5.5): 556039.00
ACD/KOC (pH 5.5): 450730.88
ACD/LogD (pH 7.4): 7.86
ACD/BCF (pH 7.4): 556039.63
ACD/KOC (pH 7.4): 450731.38
Polar Surface Area: 29 Å2
Polarizability: 49.3±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 366.3±3.0 cm3

Click to predict properties on the Chemicalize site


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