ChemSpider 2D Image | 3-[(3beta,5alpha,17beta)-3-Hydroxyandrost-14-en-17-yl]-2(5H)-furanone | C23H32O3

3-[(3β,5α,17β)-3-Hydroxyandrost-14-en-17-yl]-2(5H)-furanone

  • Molecular FormulaC23H32O3
  • Average mass356.498 Da
  • Monoisotopic mass356.235138 Da
  • ChemSpider ID35293825

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

2(5H)-Furanone, 3-[(3β,5α,17β)-3-hydroxyandrost-14-en-17-yl]- [ACD/Index Name]
3-[(3β,5α,17β)-3-Hydroxyandrost-14-en-17-yl]-2(5H)-furanon [German] [ACD/IUPAC Name]
3-[(3β,5α,17β)-3-Hydroxyandrost-14-en-17-yl]-2(5H)-furanone [ACD/IUPAC Name]
3-[(3β,5α,17β)-3-Hydroxyandrost-14-én-17-yl]-2(5H)-furanone [French] [ACD/IUPAC Name]
[3080-20-4] [RN]
3080-20-4 [RN]
β-Anhydrouzarigenin
MFCD20274831
β-Anhydrouzarigenin
β-Anhydrouzarigenin

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

Density: 1.2±0.1 g/cm3
Boiling Point: 537.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.6±6.0 kJ/mol
Flash Point: 217.0±22.9 °C
Index of Refraction: 1.581
Molar Refractivity: 101.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 4.48
ACD/BCF (pH 5.5): 1498.74
ACD/KOC (pH 5.5): 6528.06
ACD/LogD (pH 7.4): 4.48
ACD/BCF (pH 7.4): 1498.74
ACD/KOC (pH 7.4): 6528.06
Polar Surface Area: 47 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 47.9±5.0 dyne/cm
Molar Volume: 302.8±5.0 cm3

Click to predict properties on the Chemicalize site


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