ChemSpider 2D Image | Androsta-3,5-dien-17-ol, 3-methoxy-17-(2-propenyl)-, (17β)- | C23H34O2

Androsta-3,5-dien-17-ol, 3-methoxy-17-(2-propenyl)-, (17β)-

  • Molecular FormulaC23H34O2
  • Average mass342.515 Da
  • Monoisotopic mass342.255890 Da
  • ChemSpider ID21167501
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






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

(8R,9S,10R,13S,14S,17R)-17-Allyl-3-methoxy-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol [ACD/IUPAC Name]
(8R,9S,10R,13S,14S,17R)-17-Allyl-3-methoxy-10,13-dimethyl-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol [German] [ACD/IUPAC Name]
(8R,9S,10R,13S,14S,17R)-17-Allyl-3-méthoxy-10,13-diméthyl-2,7,8,9,10,11,12,13,14,15,16,17-dodécahydro-1H-cyclopenta[a]phénanthrén-17-ol [French] [ACD/IUPAC Name]
305-294-7 [EINECS]
94405-98-8 [RN]
Androsta-3,5-dien-17-ol, 3-methoxy-17-(2-propenyl)-, (17β)-
(17β)-17-allyl-3-methoxyandrosta-3,5-dien-17-ol

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 465.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.8±6.0 kJ/mol
Flash Point: 195.3±23.0 °C
Index of Refraction: 1.557
Molar Refractivity: 102.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.88
ACD/LogD (pH 5.5): 5.48
ACD/BCF (pH 5.5): 8554.90
ACD/KOC (pH 5.5): 22712.76
ACD/LogD (pH 7.4): 5.48
ACD/BCF (pH 7.4): 8554.90
ACD/KOC (pH 7.4): 22712.76
Polar Surface Area: 29 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 41.5±5.0 dyne/cm
Molar Volume: 319.2±5.0 cm3

Click to predict properties on the Chemicalize site






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