ChemSpider 2D Image | 3-dehydro-4-methylzymosterol | C28H44O

3-dehydro-4-methylzymosterol

  • Molecular FormulaC28H44O
  • Average mass396.648 Da
  • Monoisotopic mass396.339203 Da
  • ChemSpider ID21865766

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(5α)-4-Methylcholesta-8,24-dien-3-on [German] [ACD/IUPAC Name]
(5α)-4-Methylcholesta-8,24-dien-3-one [ACD/IUPAC Name]
(5α)-4-Méthylcholesta-8,24-dién-3-one [French] [ACD/IUPAC Name]
3-dehydro-4-methylzymosterol
Cholesta-8,24-dien-3-one, 4-methyl-, (5α)- [ACD/Index Name]
3-Keto-4-methylzymosterol
4-methyl-5α-cholesta-8(9),24-dien-3-one
4-methyl-5α-cholesta-8,24-dien-3-one
4α-methyl-5α-cholesta-8,24-dien-3-one

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

CHEBI:50593 [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 488.1±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 204.7±23.4 °C
Index of Refraction: 1.527
Molar Refractivity: 122.7±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 9.57
ACD/LogD (pH 5.5): 8.31
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 792896.75
ACD/LogD (pH 7.4): 8.31
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 792896.75
Polar Surface Area: 17 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 37.2±5.0 dyne/cm
Molar Volume: 398.9±5.0 cm3

Click to predict properties on the Chemicalize site


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