ChemSpider 2D Image | (2S,2'S)-2,2'-[(~2~H_4_)-1,2-Ethanediyldiimino]di(1-butanol) | C10H20D4N2O2

(2S,2'S)-2,2'-[(2H4)-1,2-Ethanediyldiimino]di(1-butanol)

  • Molecular FormulaC10H20D4N2O2
  • Average mass208.334 Da
  • Monoisotopic mass208.208878 Da
  • ChemSpider ID28295617

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S,2'S)-2,2'-[(2H4)-1,2-Ethandiyldiimino]di(1-butanol) [German] [ACD/IUPAC Name]
(2S,2'S)-2,2'-[(2H4)-1,2-Ethanediyldiimino]di(1-butanol) [ACD/IUPAC Name]
(2S,2'S)-2,2'-[(2H4)-1,2-Éthanediyldiimino]di(1-butanol) [French] [ACD/IUPAC Name]
1-Butanol, 2,2'-(1,2-ethanediyl-d4diimino)bis-, (2S,2'S)- [ACD/Index Name]
(+)-2,2'-(Ethylenediamino)di-1-butanol
(2S)-2-[[1,1,2,2-tetradeuterio-2-[[(2S)-1-hydroxybutan-2-yl]amino]ethyl]amino]butan-1-ol
(2S,2'S)-Ethambutol-d4 (ethylene-d4)
1129526-19-7 [RN]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 345.3±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 68.3±6.0 kJ/mol
    Flash Point: 113.7±12.9 °C
    Index of Refraction: 1.478
    Molar Refractivity: 58.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 4
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: -0.05
    ACD/LogD (pH 5.5): -3.35
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.13
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 65 Å2
    Polarizability: 23.2±0.5 10-24cm3
    Surface Tension: 38.1±3.0 dyne/cm
    Molar Volume: 207.0±3.0 cm3

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