ChemSpider 2D Image | (8alpha,9beta,10alpha,13alpha,14beta,17alpha)-21-Hydroxy(2,3,4-~13~C_3_)pregn-4-ene-3,11,20-trione | C1813C3H28O4

(8α,9β,10α,13α,14β,17α)-21-Hydroxy(2,3,4-13C3)pregn-4-ene-3,11,20-trione

  • Molecular FormulaC1813C3H28O4
  • Average mass347.423 Da
  • Monoisotopic mass347.208832 Da
  • ChemSpider ID111310615

  • defined stereocentres - 6 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(8α,9β,10α,13α,14β,17α)-21-Hydroxy(2,3,4-13C3)pregn-4-en-3,11,20-trion [German] [ACD/IUPAC Name]
(8α,9β,10α,13α,14β,17α)-21-Hydroxy(2,3,4-13C3)pregn-4-ene-3,11,20-trione [ACD/IUPAC Name]
(8α,9β,10α,13α,14β,17α)-21-Hydroxy(2,3,4-13C3)prégn-4-ène-3,11,20-trione [French] [ACD/IUPAC Name]
Pregn-4-ene-3,11,20-trione-2,3,4-13C3, 21-hydroxy-, (8α,9β,10α,13α,14β,17α)- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.568
Molar Refractivity: 92.6±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 50.3±5.0 dyne/cm
Molar Volume: 283.2±5.0 cm3

Click to predict properties on the Chemicalize site


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