Found 1 result

Search term: 29214050 (Found by CSID)
ChemSpider 2D Image | (20xi)-15,20-Dihydroxycholesta-4,14-diene-3,16-dione | C27H40O4

(20ξ)-15,20-Dihydroxycholesta-4,14-diene-3,16-dione

  • Molecular FormulaC27H40O4
  • Average mass428.604 Da
  • Monoisotopic mass428.292664 Da
  • ChemSpider ID29214050

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(20ξ)-15,20-Dihydroxycholesta-4,14-dien-3,16-dion [German] [ACD/IUPAC Name]
(20ξ)-15,20-Dihydroxycholesta-4,14-diene-3,16-dione [ACD/IUPAC Name]
(20ξ)-15,20-Dihydroxycholesta-4,14-diène-3,16-dione [French] [ACD/IUPAC Name]
Cholesta-4,14-diene-3,16-dione, 15,20-dihydroxy-, (20ξ)- [ACD/Index Name]
15,20-dihydroxycholest-4,14-dien-3,16-dione
cholest-4,14-dien-15,20-diol-3,16-dione

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

Density: 1.1±0.1 g/cm3
Boiling Point: 592.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.3±6.0 kJ/mol
Flash Point: 325.9±26.6 °C
Index of Refraction: 1.562
Molar Refractivity: 121.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 4.47
ACD/BCF (pH 5.5): 1481.84
ACD/KOC (pH 5.5): 6475.02
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 1466.48
ACD/KOC (pH 7.4): 6407.90
Polar Surface Area: 75 Å2
Polarizability: 48.1±0.5 10-24cm3
Surface Tension: 47.7±5.0 dyne/cm
Molar Volume: 374.0±5.0 cm3

Click to predict properties on the Chemicalize site


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