ChemSpider 2D Image | (3beta,5alpha,6beta,7alpha,15alpha,16beta,25S)-Cholestane-3,6,7,8,15,16,26-heptol | C27H48O7

(3β,5α,6β,7α,15α,16β,25S)-Cholestane-3,6,7,8,15,16,26-heptol

  • Molecular FormulaC27H48O7
  • Average mass484.666 Da
  • Monoisotopic mass484.339996 Da
  • ChemSpider ID29216477

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

(3β,5α,6β,7α,15α,16β,25S)-Cholestan-3,6,7,8,15,16,26-heptol [German] [ACD/IUPAC Name]
(3β,5α,6β,7α,15α,16β,25S)-Cholestane-3,6,7,8,15,16,26-heptol [ACD/IUPAC Name]
(3β,5α,6β,7α,15α,16β,25S)-Cholestane-3,6,7,8,15,16,26-heptol [French] [ACD/IUPAC Name]
Cholestane-3,6,7,8,15,16,26-heptol, (3β,5α,6β,7α,15α,16β,25S)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 618.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.2±6.0 kJ/mol
Flash Point: 259.2±26.1 °C
Index of Refraction: 1.592
Molar Refractivity: 129.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.78
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 6.72
ACD/KOC (pH 5.5): 136.04
ACD/LogD (pH 7.4): 1.39
ACD/BCF (pH 7.4): 6.72
ACD/KOC (pH 7.4): 136.04
Polar Surface Area: 142 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 62.8±3.0 dyne/cm
Molar Volume: 383.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement