ChemSpider 2D Image | (16alpha)-3,16-Dihydroxypregn-5-en-20-one | C21H32O3

(16α)-3,16-Dihydroxypregn-5-en-20-one

  • Molecular FormulaC21H32O3
  • Average mass332.477 Da
  • Monoisotopic mass332.235138 Da
  • ChemSpider ID22889263

  • defined stereocentres - 1 of 8 defined stereocentres

More details:

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

(16α)-3,16-Dihydroxypregn-5-en-20-on [German] [ACD/IUPAC Name]
(16α)-3,16-Dihydroxypregn-5-en-20-one [ACD/IUPAC Name]
(16α)-3,16-Dihydroxyprégn-5-én-20-one [French] [ACD/IUPAC Name]
Pregn-5-en-20-one, 3,16-dihydroxy-, (16α)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 482.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 86.2±6.0 kJ/mol
Flash Point: 259.9±25.2 °C
Index of Refraction: 1.565
Molar Refractivity: 93.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 148.91
ACD/KOC (pH 5.5): 1250.20
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 148.91
ACD/KOC (pH 7.4): 1250.20
Polar Surface Area: 58 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 47.7±5.0 dyne/cm
Molar Volume: 288.0±5.0 cm3

Click to predict properties on the Chemicalize site


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