ChemSpider 2D Image | (11alpha,17beta)-11-Hydroxy-3-oxoandrost-4-ene-17-carboxylic acid | C20H28O4

(11α,17β)-11-Hydroxy-3-oxoandrost-4-ene-17-carboxylic acid

  • Molecular FormulaC20H28O4
  • Average mass332.434 Da
  • Monoisotopic mass332.198761 Da
  • ChemSpider ID24840621

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(11α,17β)-11-Hydroxy-3-oxoandrost-4-en-17-carbonsäure [German] [ACD/IUPAC Name]
(11α,17β)-11-Hydroxy-3-oxoandrost-4-ene-17-carboxylic acid [ACD/IUPAC Name]
Acide (11α,17β)-11-hydroxy-3-oxoandrost-4-ène-17-carboxylique [French] [ACD/IUPAC Name]
Androst-4-ene-17-carboxylic acid, 11-hydroxy-3-oxo-, (11α,17β)- [ACD/Index Name]
(1S,2R,10S,11S,14S,15S,17R)-17-hydroxy-2,15-dimethyl-5-oxotetracyclo[8.7.0.02,7.011,15]heptadec-6-ene-14-carboxylic acid
11b-Hydroxyprogesterone
11β-hydroxyprogesterone
11β-hydroxypregn-4-ene-3,20-dione
11-β-Hydroxypregn-4-ene-3,20-dione
11β-hydroxyprogesterone
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.2±0.1 g/cm3
Boiling Point: 527.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 92.2±6.0 kJ/mol
Flash Point: 286.6±26.6 °C
Index of Refraction: 1.581
Molar Refractivity: 89.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 1.44
ACD/BCF (pH 5.5): 4.56
ACD/KOC (pH 5.5): 58.41
ACD/LogD (pH 7.4): -0.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 268.1±5.0 cm3

Click to predict properties on the Chemicalize site


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