ChemSpider 2D Image | (10xi,13xi)-Pregn-5-ene-3,20-dione | C21H30O2

(10ξ,13ξ)-Pregn-5-ene-3,20-dione

  • Molecular FormulaC21H30O2
  • Average mass314.462 Da
  • Monoisotopic mass314.224579 Da
  • ChemSpider ID58816558

  • defined stereocentres - 4 of 6 defined stereocentres

More details:

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

(10ξ,13ξ)-Pregn-5-en-3,20-dion [German] [ACD/IUPAC Name]
(10ξ,13ξ)-Pregn-5-ene-3,20-dione [ACD/IUPAC Name]
(10ξ,13ξ)-Prégn-5-ène-3,20-dione [French] [ACD/IUPAC Name]
Pregn-5-ene-3,20-dione, (10ξ,13ξ)- [ACD/Index Name]
1236-09-5 [RN]
5-Pregnene-3,20-dione
Pregn-5-ene-3,20-dione [ACD/Index Name] [ACD/IUPAC 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: 440.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.7±3.0 kJ/mol
Flash Point: 164.2±25.7 °C
Index of Refraction: 1.542
Molar Refractivity: 91.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 4.06
ACD/BCF (pH 5.5): 715.02
ACD/KOC (pH 5.5): 3843.45
ACD/LogD (pH 7.4): 4.06
ACD/BCF (pH 7.4): 715.02
ACD/KOC (pH 7.4): 3843.45
Polar Surface Area: 34 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 289.0±5.0 cm3

Click to predict properties on the Chemicalize site


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