ChemSpider 2D Image | (3beta,9xi,14xi,17xi,24Z)-Stigmasta-5,7,24(28)-trien-3-ol | C29H46O

(3β,9ξ,14ξ,17ξ,24Z)-Stigmasta-5,7,24(28)-trien-3-ol

  • Molecular FormulaC29H46O
  • Average mass410.675 Da
  • Monoisotopic mass410.354858 Da
  • ChemSpider ID30792036

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 7 defined stereocentres

More details:

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

(3β,9ξ,14ξ,17ξ,24Z)-Stigmasta-5,7,24(28)-trien-3-ol [German] [ACD/IUPAC Name]
(3β,9ξ,14ξ,17ξ,24Z)-Stigmasta-5,7,24(28)-trien-3-ol [ACD/IUPAC Name]
(3β,9ξ,14ξ,17ξ,24Z)-Stigmasta-5,7,24(28)-trién-3-ol [French] [ACD/IUPAC Name]
Stigmasta-5,7,24(28)-trien-3-ol, (3β,9ξ,14ξ,17ξ,24Z)- [ACD/Index Name]
5-dehydroavenasterol

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

Density: 1.0±0.1 g/cm3
Boiling Point: 516.8±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.8±6.0 kJ/mol
Flash Point: 223.2±19.3 °C
Index of Refraction: 1.541
Molar Refractivity: 128.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 10.03
ACD/LogD (pH 5.5): 8.47
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 963061.50
ACD/LogD (pH 7.4): 8.47
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 963061.50
Polar Surface Area: 20 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 38.9±5.0 dyne/cm
Molar Volume: 409.5±5.0 cm3

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