Found 1 result

Search term: 1133425-75-8 (Found by approved synonym)
ChemSpider 2D Image | Deferasirox-d4 | C21H11D4N3O4

Deferasirox-d4

  • Molecular FormulaC21H11D4N3O4
  • Average mass377.386 Da
  • Monoisotopic mass377.131378 Da
  • ChemSpider ID31045862

  • Non-standard isotope - Non-standard isotope

More details:

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

1133425-75-8 [RN]
4-[3,5-Bis(2-hydroxyphenyl)-1H-1,2,4-triazol-1-yl](2H4)benzoesäure [German] [ACD/IUPAC Name]
4-[3,5-Bis(2-hydroxyphenyl)-1H-1,2,4-triazol-1-yl](2H4)benzoic acid [ACD/IUPAC Name]
Acide 4-[3,5-bis(2-hydroxyphényl)-1H-1,2,4-triazol-1-yl](2H4)benzoïque [French] [ACD/IUPAC Name]
Benzoic-2,3,5,6-d4 acid, 4-[3,5-bis(2-hydroxyphenyl)-1H-1,2,4-triazol-1-yl]- [ACD/Index Name]
Deferasirox-d4
CGP-72670-d4

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 672.1±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 103.7±3.0 kJ/mol
    Flash Point: 360.3±34.3 °C
    Index of Refraction: 1.699
    Molar Refractivity: 102.6±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 6.43
    ACD/LogD (pH 5.5): 2.29
    ACD/BCF (pH 5.5): 10.98
    ACD/KOC (pH 5.5): 53.34
    ACD/LogD (pH 7.4): 0.83
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.85
    Polar Surface Area: 108 Å2
    Polarizability: 40.7±0.5 10-24cm3
    Surface Tension: 60.8±7.0 dyne/cm
    Molar Volume: 265.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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