ChemSpider 2D Image | 5,7,24(28)-Ergostatrienol | C28H44O

5,7,24(28)-Ergostatrienol

  • Molecular FormulaC28H44O
  • Average mass396.648 Da
  • Monoisotopic mass396.339203 Da
  • ChemSpider ID30792038

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(3β,9ξ)-Ergosta-5,7,24(28)-trien-3-ol [German] [ACD/IUPAC Name]
(3β,9ξ)-Ergosta-5,7,24(28)-trien-3-ol [ACD/IUPAC Name]
(3β,9ξ)-Ergosta-5,7,24(28)-trién-3-ol [French] [ACD/IUPAC Name]
5,7,24(28)-Ergostatrienol
Ergosta-5,7,24(28)-trien-3-ol, (3β,9ξ)- [ACD/Index Name]
5-dehydro episterol

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

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

Density: 1.0±0.1 g/cm3
Boiling Point: 503.2±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.9±6.0 kJ/mol
Flash Point: 216.8±19.3 °C
Index of Refraction: 1.539
Molar Refractivity: 123.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 9.51
ACD/LogD (pH 5.5): 8.15
ACD/BCF (pH 5.5): 927974.38
ACD/KOC (pH 5.5): 650325.63
ACD/LogD (pH 7.4): 8.15
ACD/BCF (pH 7.4): 927974.38
ACD/KOC (pH 7.4): 650325.63
Polar Surface Area: 20 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 38.5±5.0 dyne/cm
Molar Volume: 395.3±5.0 cm3

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