ChemSpider 2D Image | Camphoratin H | C29H44O2

Camphoratin H

  • Molecular FormulaC29H44O2
  • Average mass424.659 Da
  • Monoisotopic mass424.334137 Da
  • ChemSpider ID26376474

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(4α,5α)-4-Methylergosta-8,24(28)-dien-3,11-dion [German] [ACD/IUPAC Name]
(4α,5α)-4-Methylergosta-8,24(28)-diene-3,11-dione [ACD/IUPAC Name]
(4α,5α)-4-Méthylergosta-8,24(28)-diène-3,11-dione [French] [ACD/IUPAC Name]
Camphoratin H
Ergosta-8,24(28)-diene-3,11-dione, 4-methyl-, (4α,5α)- [ACD/Index Name]
4α-methylergosta-8,24(28)-diene-3,11-dione
camphoratin G

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

Density: 1.0±0.1 g/cm3
Boiling Point: 530.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.5±3.0 kJ/mol
Flash Point: 195.0±27.1 °C
Index of Refraction: 1.526
Molar Refractivity: 127.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.82
ACD/LogD (pH 5.5): 6.85
ACD/BCF (pH 5.5): 94959.74
ACD/KOC (pH 5.5): 127204.42
ACD/LogD (pH 7.4): 6.85
ACD/BCF (pH 7.4): 94959.74
ACD/KOC (pH 7.4): 127204.42
Polar Surface Area: 34 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 38.2±5.0 dyne/cm
Molar Volume: 414.5±5.0 cm3

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