ChemSpider 2D Image | (2S,7R,9aR)-7-(2,4-Dichlorophenyl)-2-(2-methyl-2-propanyl)octahydro-2H-quinolizin-2-ol | C19H27Cl2NO

(2S,7R,9aR)-7-(2,4-Dichlorophenyl)-2-(2-methyl-2-propanyl)octahydro-2H-quinolizin-2-ol

  • Molecular FormulaC19H27Cl2NO
  • Average mass356.330 Da
  • Monoisotopic mass355.146973 Da
  • ChemSpider ID18531163

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S,7R,9aR)-7-(2,4-Dichlorophenyl)-2-(2-methyl-2-propanyl)octahydro-2H-quinolizin-2-ol [ACD/IUPAC Name]
(2S,7R,9aR)-7-(2,4-Dichlorophényl)-2-(2-méthyl-2-propanyl)octahydro-2H-quinolizin-2-ol [French] [ACD/IUPAC Name]
(2S,7R,9aR)-7-(2,4-Dichlorphenyl)-2-(2-methyl-2-propanyl)octahydro-2H-chinolizin-2-ol [German] [ACD/IUPAC Name]
2H-Quinolizin-2-ol, 7-(2,4-dichlorophenyl)-2-(1,1-dimethylethyl)octahydro-, (2S,7R,9aR)- [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: 452.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 227.5±28.7 °C
Index of Refraction: 1.582
Molar Refractivity: 97.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.11
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 5.10
ACD/KOC (pH 5.5): 16.09
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 111.88
ACD/KOC (pH 7.4): 352.76
Polar Surface Area: 23 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 47.9±5.0 dyne/cm
Molar Volume: 293.2±5.0 cm3

Click to predict properties on the Chemicalize site


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