ChemSpider 2D Image | 5alpha-Stigmastan-3,6-dione | C29H48O2

5α-Stigmastan-3,6-dione

  • Molecular FormulaC29H48O2
  • Average mass428.690 Da
  • Monoisotopic mass428.365417 Da
  • ChemSpider ID20038712
  • defined stereocentres - 9 of 9 defined stereocentres


More details:






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

(5α)-Stigmastan-3,6-dion [German] [ACD/IUPAC Name]
(5α)-Stigmastane-3,6-dione [ACD/IUPAC Name]
(5α)-Stigmastane-3,6-dione [French] [ACD/IUPAC Name]
5α-Stigmastan-3,6-dione
5α-Stigmastane-3,6-dione
Stigmastane-3,6-dione, (5α)-
Stigmastane-3,6-dione, (5α)- [ACD/Index Name]
22149-69-5 [RN]
5α-Stigmastane-3,6-dione
MFCD20260341
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 519.5±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 191.5±22.4 °C
Index of Refraction: 1.501
Molar Refractivity: 128.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 8.37
ACD/LogD (pH 5.5): 6.89
ACD/BCF (pH 5.5): 101035.88
ACD/KOC (pH 5.5): 132978.88
ACD/LogD (pH 7.4): 6.89
ACD/BCF (pH 7.4): 101035.88
ACD/KOC (pH 7.4): 132978.88
Polar Surface Area: 34 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 35.1±3.0 dyne/cm
Molar Volume: 435.5±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement