ChemSpider 2D Image | (3Z,5alpha,17xi)-N-Methoxycholestan-3-imine | C28H49NO

(3Z,5α,17ξ)-N-Methoxycholestan-3-imine

  • Molecular FormulaC28H49NO
  • Average mass415.695 Da
  • Monoisotopic mass415.381409 Da
  • ChemSpider ID109121666

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 8 defined stereocentres

More details:

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

(3Z,5α,17ξ)-N-Methoxycholestan-3-imin [German] [ACD/IUPAC Name]
(3Z,5α,17ξ)-N-Methoxycholestan-3-imine [ACD/IUPAC Name]
(3Z,5α,17ξ)-N-Méthoxycholestan-3-imine [French] [ACD/IUPAC Name]
Cholestan-3-one, O-methyloξme, (3Z,5α,17ξ)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 484.0±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 197.6±16.5 °C
Index of Refraction: 1.566
Molar Refractivity: 125.8±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 10.91
ACD/LogD (pH 5.5): 9.64
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4183581.00
ACD/LogD (pH 7.4): 9.64
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 4183581.00
Polar Surface Area: 22 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 35.3±7.0 dyne/cm
Molar Volume: 385.7±7.0 cm3

Click to predict properties on the Chemicalize site


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