ChemSpider 2D Image | 24,24-Diphenylchol-23-ene-3,12-diyl diacetate | C40H52O4

24,24-Diphenylchol-23-ene-3,12-diyl diacetate

  • Molecular FormulaC40H52O4
  • Average mass596.839 Da
  • Monoisotopic mass596.386536 Da
  • ChemSpider ID224755

More details:






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

24,24-Diphenylchol-23-en-3,12-diyl-diacetat [German] [ACD/IUPAC Name]
24,24-Diphenylchol-23-ene-3,12-diyl diacetate [ACD/IUPAC Name]
Chol-23-ene-3,12-diol, 24,24-diphenyl-, diacetate [ACD/Index Name]
Diacétate de 24,24-diphénylchol-23-ène-3,12-diyle [French] [ACD/IUPAC Name]
3,12-Diacetoxy-bis-nor-cholanyldiphenylethylene
53608-88-1 [RN]
53925-27-2 [RN]

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

NSC82872 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 648.4±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.6±3.0 kJ/mol
Flash Point: 315.1±26.9 °C
Index of Refraction: 1.575
Molar Refractivity: 176.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 11.59
ACD/LogD (pH 5.5): 10.06
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 7028178.00
ACD/LogD (pH 7.4): 10.06
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 7028178.00
Polar Surface Area: 53 Å2
Polarizability: 69.8±0.5 10-24cm3
Surface Tension: 46.6±5.0 dyne/cm
Molar Volume: 533.0±5.0 cm3

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