Found 31 results

Search term: JERGUCIJOXJXHF (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 17α-HYDROXYPREGNENOLONE-21,21,21-D3 | C21H29D3O3

17α-HYDROXYPREGNENOLONE-21,21,21-D3

  • Molecular FormulaC21H29D3O3
  • Average mass335.496 Da
  • Monoisotopic mass335.253967 Da
  • ChemSpider ID23630262

  • defined stereocentres - 7 of 7 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3β)-3,17-Dihydroxy(21,21,21-2H3)pregn-5-en-20-on [German] [ACD/IUPAC Name]
(3β)-3,17-Dihydroxy(21,21,21-2H3)pregn-5-en-20-one [ACD/IUPAC Name]
(3β)-3,17-Dihydroxy(21,21,21-2H3)prégn-5-én-20-one [French] [ACD/IUPAC Name]
105078-92-0 [RN]
17α-HYDROXYPREGNENOLONE-21,21,21-D3
Pregn-5-en-20-one-21,21,21-d3, 3,17-dihydroxy-, (3β)- [ACD/Index Name]
1-(3-Iodo-propoxy)-4-methoxy-benzene
17?-Hydroxy pregnenolone-d3
17α-Hydroxypregnenolone-21,21,21-d3
2,2,2-trideuterio-1-[(3S,8R,9S,10R,13S,14S,17R)-3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]ethanone

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 478.4±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 85.6±6.0 kJ/mol
    Flash Point: 257.2±25.2 °C
    Index of Refraction: 1.568
    Molar Refractivity: 93.9±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.38
    ACD/LogD (pH 5.5): 3.63
    ACD/BCF (pH 5.5): 336.93
    ACD/KOC (pH 5.5): 2242.95
    ACD/LogD (pH 7.4): 3.63
    ACD/BCF (pH 7.4): 336.93
    ACD/KOC (pH 7.4): 2242.95
    Polar Surface Area: 58 Å2
    Polarizability: 37.2±0.5 10-24cm3
    Surface Tension: 48.3±5.0 dyne/cm
    Molar Volume: 287.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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