ChemSpider 2D Image | MFCD00056426 | C24H36O3

MFCD00056426

  • Molecular FormulaC24H36O3
  • Average mass372.541 Da
  • Monoisotopic mass372.266449 Da
  • ChemSpider ID20055088

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3β,16α)-16-Methyl-20-oxopregn-5-en-3-yl acetate [ACD/IUPAC Name]
(3β,16α)-16-Methyl-20-oxopregn-5-en-3-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (3β,16α)-16-méthyl-20-oxoprégn-5-én-3-yle [French] [ACD/IUPAC Name]
MFCD00056426
Pregn-5-en-20-one, 3-(acetyloxy)-16-methyl-, (3β,16α)-
Pregn-5-en-20-one, 3-(acetyloxy)-16-methyl-, (3β,16α)- [ACD/Index Name]
Pregn-5-en-20-one, 3β-hydroxy-16α-methyl-, acetate
[(3S,8S,9S,10R,13S,14S,16R,17S)-17-ACETYL-10,13,16-TRIMETHYL-2,3,4,7,8,9,11,12,14,15,16,17-DODECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-3-YL] ACETATE
16α-METHYLPREGNENOLONE ACETATE
1863-41-8 [RN]
More...

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

Density: 1.1±0.1 g/cm3
Boiling Point: 460.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 196.5±28.8 °C
Index of Refraction: 1.530
Molar Refractivity: 106.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.87
ACD/LogD (pH 5.5): 5.39
ACD/BCF (pH 5.5): 7403.79
ACD/KOC (pH 5.5): 20480.76
ACD/LogD (pH 7.4): 5.39
ACD/BCF (pH 7.4): 7403.79
ACD/KOC (pH 7.4): 20480.76
Polar Surface Area: 43 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 40.2±5.0 dyne/cm
Molar Volume: 344.8±5.0 cm3

Click to predict properties on the Chemicalize site


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