ChemSpider 2D Image | (22S)-22-hydroxycampest-4-en-3-one | C28H46O2

(22S)-22-hydroxycampest-4-en-3-one

  • Molecular FormulaC28H46O2
  • Average mass414.664 Da
  • Monoisotopic mass414.349792 Da
  • ChemSpider ID28533755

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(22S)-22-hydroxycampest-4-en-3-one
(22S,24R)-22-Hydroxyergost-4-en-3-on [German] [ACD/IUPAC Name]
(22S,24R)-22-Hydroxyergost-4-en-3-one [ACD/IUPAC Name]
(22S,24R)-22-Hydroxyergost-4-én-3-one [French] [ACD/IUPAC Name]
Ergost-4-en-3-one, 22-hydroxy-, (22S,24R)- [ACD/Index Name]
(22&α;)-hydroxy-campest-4-en-3-one
(22S)-22-hydroxy-campest-4-en-3-one
(22S,24R)-22-hydroxy-ergost-4-en-3-one
(22S, 24R)-22-hydroxyergost-4-en-3-one
(22S,24R)-22-Hydroxy-ergost-4 en-3-one
More...

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

Density: 1.0±0.1 g/cm3
Boiling Point: 523.6±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 91.7±6.0 kJ/mol
Flash Point: 221.2±14.1 °C
Index of Refraction: 1.528
Molar Refractivity: 124.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.52
ACD/LogD (pH 5.5): 6.16
ACD/BCF (pH 5.5): 28487.80
ACD/KOC (pH 5.5): 53731.55
ACD/LogD (pH 7.4): 6.16
ACD/BCF (pH 7.4): 28487.80
ACD/KOC (pH 7.4): 53731.55
Polar Surface Area: 37 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 39.6±5.0 dyne/cm
Molar Volume: 405.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement