ChemSpider 2D Image | CORTODOXONE 21-SULFATE | C21H30O7S

CORTODOXONE 21-SULFATE

  • Molecular FormulaC21H30O7S
  • Average mass426.524 Da
  • Monoisotopic mass426.171234 Da
  • ChemSpider ID32702006

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

17-Hydroxy-3,20-dioxopregn-4-en-21-yl hydrogen sulfate [ACD/IUPAC Name]
17-Hydroxy-3,20-dioxopregn-4-en-21-ylhydrogensulfat [German] [ACD/IUPAC Name]
3583-28-6 [RN]
CORTODOXONE 21-SULFATE
Hydrogénosulfate de 17-hydroxy-3,20-dioxoprégn-4-én-21-yle [French] [ACD/IUPAC Name]
Pregn-4-ene-3,20-dione, 17-hydroxy-21-(sulfooxy)- [ACD/Index Name]

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

33136109C2 [DBID]
UNII:33136109C2 [DBID]
UNII-33136109C2 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.593
Molar Refractivity: 104.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): -2.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 41.5±0.5 10-24cm3
Surface Tension: 61.6±5.0 dyne/cm
Molar Volume: 308.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement