ChemSpider 2D Image | (9xi,14xi)-7-Methylestr-4-ene-3,17-dione | C19H26O2

(9ξ,14ξ)-7-Methylestr-4-ene-3,17-dione

  • Molecular FormulaC19H26O2
  • Average mass286.409 Da
  • Monoisotopic mass286.193268 Da
  • ChemSpider ID29787380

  • defined stereocentres - 3 of 6 defined stereocentres

More details:

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

(9ξ,14ξ)-7-Methylestr-4-en-3,17-dion [German] [ACD/IUPAC Name]
(9ξ,14ξ)-7-Methylestr-4-ene-3,17-dione [ACD/IUPAC Name]
(9ξ,14ξ)-7-Méthylestr-4-ène-3,17-dione [French] [ACD/IUPAC Name]
Estr-4-ene-3,17-dione, 7-methyl-, (9ξ,14ξ)- [ACD/Index Name]
(7a,14b)-7-Methyl-estr-4-ene-3,17-dione
436144-67-1 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 438.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 163.5±25.7 °C
Index of Refraction: 1.549
Molar Refractivity: 81.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 114.31
ACD/KOC (pH 5.5): 1034.64
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 114.31
ACD/KOC (pH 7.4): 1034.64
Polar Surface Area: 34 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 42.0±5.0 dyne/cm
Molar Volume: 256.7±5.0 cm3

Click to predict properties on the Chemicalize site


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