ChemSpider 2D Image | 3-Ethoxy-6-methyl-3,5-androstadiene-11-beta-ol-17-one | C22H32O3

3-Ethoxy-6-methyl-3,5-androstadiene-11-β-ol-17-one

  • Molecular FormulaC22H32O3
  • Average mass344.488 Da
  • Monoisotopic mass344.235138 Da
  • ChemSpider ID23498615

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(11β)-3-Ethoxy-11-hydroxy-6-methylandrosta-3,5-dien-17-on [German] [ACD/IUPAC Name]
(11β)-3-Ethoxy-11-hydroxy-6-methylandrosta-3,5-dien-17-one [ACD/IUPAC Name]
(11β)-3-Éthoxy-11-hydroxy-6-méthylandrosta-3,5-dién-17-one [French] [ACD/IUPAC Name]
3-Ethoxy-6-methyl-3,5-androstadiene-11-β-ol-17-one
Androsta-3,5-dien-17-one, 3-ethoxy-11-hydroxy-6-methyl-, (11β)- [ACD/Index Name]
(8S,9S,10R,11S,13S,14S)-3-Ethoxy-11-hydroxy-6,10,13-trimethyl-7,8,9,10,11,12,13,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17(2H)-one
74915-66-5 [RN]
MFCD07367985 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 501.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.7±6.0 kJ/mol
Flash Point: 171.5±23.6 °C
Index of Refraction: 1.558
Molar Refractivity: 98.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.64
ACD/LogD (pH 5.5): 3.99
ACD/BCF (pH 5.5): 631.98
ACD/KOC (pH 5.5): 3518.41
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 631.98
ACD/KOC (pH 7.4): 3518.41
Polar Surface Area: 47 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 43.9±5.0 dyne/cm
Molar Volume: 304.7±5.0 cm3

Click to predict properties on the Chemicalize site


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