ChemSpider 2D Image | (3alpha,8xi,9xi,10xi,13xi,14xi,17xi)-N,N-Dimethylcholest-5-en-3-amine | C29H51N

(3α,8ξ,9ξ,10ξ,13ξ,14ξ,17ξ)-N,N-Dimethylcholest-5-en-3-amine

  • Molecular FormulaC29H51N
  • Average mass413.722 Da
  • Monoisotopic mass413.402161 Da
  • ChemSpider ID22889777

  • defined stereocentres - 2 of 8 defined stereocentres

More details:

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

(3α,8ξ,9ξ,10ξ,13ξ,14ξ,17ξ)-N,N-Dimethylcholest-5-en-3-amin [German] [ACD/IUPAC Name]
(3α,8ξ,9ξ,10ξ,13ξ,14ξ,17ξ)-N,N-Dimethylcholest-5-en-3-amine [ACD/IUPAC Name]
(3α,8ξ,9ξ,10ξ,13ξ,14ξ,17ξ)-N,N-Diméthylcholest-5-én-3-amine [French] [ACD/IUPAC Name]
Cholest-5-en-3-amine, N,N-dimethyl-, (3α,8ξ,9ξ,10ξ,13ξ,14ξ,17ξ)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 485.4±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 215.9±19.8 °C
Index of Refraction: 1.520
Molar Refractivity: 131.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 10.65
ACD/LogD (pH 5.5): 6.01
ACD/BCF (pH 5.5): 4002.13
ACD/KOC (pH 5.5): 1783.38
ACD/LogD (pH 7.4): 6.93
ACD/BCF (pH 7.4): 33310.79
ACD/KOC (pH 7.4): 14843.52
Polar Surface Area: 3 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 36.3±5.0 dyne/cm
Molar Volume: 432.7±5.0 cm3

Click to predict properties on the Chemicalize site


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