ChemSpider 2D Image | 4alpha-Methylzymosterol | C28H46O

4α-Methylzymosterol

  • Molecular FormulaC28H46O
  • Average mass398.664 Da
  • Monoisotopic mass398.354858 Da
  • ChemSpider ID20036827
  • defined stereocentres - 8 of 8 defined stereocentres


More details:






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

(3β,4α,5α)-4-Methylcholesta-8,24-dien-3-ol [ACD/IUPAC Name]
(3β,4α,5α)-4-Methylcholesta-8,24-dien-3-ol [German] [ACD/IUPAC Name]
(3β,4α,5α)-4-Méthylcholesta-8,24-dién-3-ol [French] [ACD/IUPAC Name]
4a-Methyl-5a-cholesta-8(9),24-dien-3b-ol
4a-Methyl-5a-cholesta-8,24-dien-3b-ol
4α-Methylzymosterol
Cholesta-8,24-dien-3-ol, 4-methyl-, (3β,4α,5α)- [ACD/Index Name]
(2S,5S,6S,7S,11R,14R,15R)-2,6,15-trimethyl-14-[(2R)-6-methylhept-5-en-2-yl]tetracyclo[8.7.0.02,7.011,15]heptadec-1(10)-en-5-ol
(2S,5S,6S,7S,11R,14R,15R)-2,6,15-trimethyl-14-[(2R)-6-methylhept-5-en-2-yl]tetracyclo[8.7.0.02,7.011,15]heptadec-1(10)-en-5-ol
(3b,4a,5a)-4-methylcholesta-8,24-dien-3-ol
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.0±0.1 g/cm3
Boiling Point: 490.4±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.2±6.0 kJ/mol
Flash Point: 213.8±20.7 °C
Index of Refraction: 1.533
Molar Refractivity: 124.1±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 9.98
ACD/LogD (pH 5.5): 8.94
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1732013.00
ACD/LogD (pH 7.4): 8.94
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1732013.00
Polar Surface Area: 20 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 38.3±5.0 dyne/cm
Molar Volume: 400.0±5.0 cm3

Click to predict properties on the Chemicalize site






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