ChemSpider 2D Image | (10S)-7,7-Dimethyl-10-(4-propylphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione | C27H27NO2

(10S)-7,7-Dimethyl-10-(4-propylphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione

  • Molecular FormulaC27H27NO2
  • Average mass397.509 Da
  • Monoisotopic mass397.204193 Da
  • ChemSpider ID62644284

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(10S)-7,7-Dimethyl-10-(4-propylphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]chinolin-9,11-dion [German] [ACD/IUPAC Name]
(10S)-7,7-Diméthyl-10-(4-propylphényl)-6,7,8,10-tétrahydro-5H-indéno[1,2-b]quinoléine-9,11-dione [French] [ACD/IUPAC Name]
(10S)-7,7-Dimethyl-10-(4-propylphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione [ACD/IUPAC Name]
5H-Indeno[1,2-b]quinoline-9,11-dione, 6,7,8,10-tetrahydro-7,7-dimethyl-10-(4-propylphenyl)-, (10S)- [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: 594.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 182.8±30.3 °C
Index of Refraction: 1.642
Molar Refractivity: 117.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.69
ACD/LogD (pH 5.5): 5.92
ACD/BCF (pH 5.5): 18625.35
ACD/KOC (pH 5.5): 39639.43
ACD/LogD (pH 7.4): 5.92
ACD/BCF (pH 7.4): 18625.35
ACD/KOC (pH 7.4): 39639.43
Polar Surface Area: 46 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 325.6±5.0 cm3

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