ChemSpider 2D Image | (3alpha,4alpha,5alpha,9beta)-4,14-Dimethyl-9,19-cycloergost-24(28)-en-3-ol | C30H50O

(3α,4α,5α,9β)-4,14-Dimethyl-9,19-cycloergost-24(28)-en-3-ol

  • Molecular FormulaC30H50O
  • Average mass426.717 Da
  • Monoisotopic mass426.386169 Da
  • ChemSpider ID23283665

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(3α,4α,5α,9β)-4,14-Dimethyl-9,19-cycloergost-24(28)-en-3-ol [ACD/IUPAC Name]
(3α,4α,5α,9β)-4,14-Dimethyl-9,19-cycloergost-24(28)-en-3-ol [German] [ACD/IUPAC Name]
(3α,4α,5α,9β)-4,14-Diméthyl-9,19-cycloergost-24(28)-én-3-ol [French] [ACD/IUPAC Name]
9,19-Cycloergost-24(28)-en-3-ol, 4,14-dimethyl-, (3α,4α,5α,9β)- [ACD/Index Name]
3-epicycloeucalenol
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL390109/

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

Density: 1.0±0.1 g/cm3
Boiling Point: 508.0±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 89.6±6.0 kJ/mol
Flash Point: 222.7±13.7 °C
Index of Refraction: 1.534
Molar Refractivity: 131.7±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 10.54
ACD/LogD (pH 5.5): 9.02
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1913529.13
ACD/LogD (pH 7.4): 9.02
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1913529.13
Polar Surface Area: 20 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 38.8±5.0 dyne/cm
Molar Volume: 423.8±5.0 cm3

Click to predict properties on the Chemicalize site


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