ChemSpider 2D Image | (3alpha,5alpha)-17-Phenylandrost-16-en-3-ol | C25H34O

(3α,5α)-17-Phenylandrost-16-en-3-ol

  • Molecular FormulaC25H34O
  • Average mass350.537 Da
  • Monoisotopic mass350.260956 Da
  • ChemSpider ID21475142
  • defined stereocentres - 7 of 7 defined stereocentres


More details:






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

(3α,5α)-17-Phenylandrost-16-en-3-ol [ACD/IUPAC Name]
(3α,5α)-17-Phenylandrost-16-en-3-ol [German] [ACD/IUPAC Name]
(3α,5α)-17-Phénylandrost-16-én-3-ol [French] [ACD/IUPAC Name]
Androst-16-en-3-ol, 17-phenyl-, (3α,5α)- [ACD/Index Name]
17-PA
17-Phenyl-(3a,5a)-androst-16-en-3-ol
694438-95-4 [RN]
  • Miscellaneous
    • Bio Activity:

      Antagonist of neurosteroid potentiation and direct gating of GABAA Tocris Bioscience [2681]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 472.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 197.4±21.0 °C
Index of Refraction: 1.572
Molar Refractivity: 107.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 7.33
ACD/LogD (pH 5.5): 5.98
ACD/BCF (pH 5.5): 20599.97
ACD/KOC (pH 5.5): 42604.18
ACD/LogD (pH 7.4): 5.98
ACD/BCF (pH 7.4): 20599.97
ACD/KOC (pH 7.4): 42604.18
Polar Surface Area: 20 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 326.6±3.0 cm3

Click to predict properties on the Chemicalize site


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