ChemSpider 2D Image | (3beta)-3-(Tetrahydro-2H-pyran-2-yloxy)androst-5-en-17-one | C24H36O3

(3β)-3-(Tetrahydro-2H-pyran-2-yloxy)androst-5-en-17-one

  • Molecular FormulaC24H36O3
  • Average mass372.541 Da
  • Monoisotopic mass372.266449 Da
  • ChemSpider ID22875429

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(3β)-3-(Tetrahydro-2H-pyran-2-yloxy)androst-5-en-17-on [German] [ACD/IUPAC Name]
(3β)-3-(Tetrahydro-2H-pyran-2-yloxy)androst-5-en-17-one [ACD/IUPAC Name]
(3β)-3-(Tétrahydro-2H-pyran-2-yloxy)androst-5-én-17-one [French] [ACD/IUPAC Name]
Androst-5-en-17-one, 3-[(tetrahydro-2H-pyran-2-yl)oxy]-, (3β)- [ACD/Index Name]
(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-3-(oxan-2-yloxy)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
19637-35-5 [RN]
3??-hydroxy-5-androsten-17-one 3-tetrahydropyranyl ether
MCULE-1546412853
MolPort-002-529-209
STOCK1N-57040

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 493.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.0±3.0 kJ/mol
    Flash Point: 244.2±15.1 °C
    Index of Refraction: 1.547
    Molar Refractivity: 106.2±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.36
    ACD/LogD (pH 5.5): 4.20
    ACD/BCF (pH 5.5): 916.32
    ACD/KOC (pH 5.5): 4590.21
    ACD/LogD (pH 7.4): 4.20
    ACD/BCF (pH 7.4): 916.32
    ACD/KOC (pH 7.4): 4590.21
    Polar Surface Area: 36 Å2
    Polarizability: 42.1±0.5 10-24cm3
    Surface Tension: 42.9±5.0 dyne/cm
    Molar Volume: 334.6±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement