ChemSpider 2D Image | 4-Acetamido(~2~H_4_)benzoic acid | C9H5D4NO3

4-Acetamido(2H4)benzoic acid

  • Molecular FormulaC9H5D4NO3
  • Average mass183.197 Da
  • Monoisotopic mass183.083344 Da
  • ChemSpider ID48058186

  • Non-standard isotope - Non-standard isotope

More details:

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

4-Acetamido(2H4)benzoesäure [German] [ACD/IUPAC Name]
4-Acetamido(2H4)benzoic acid [ACD/IUPAC Name]
Acide 4-acétamido(2H4)benzoïque [French] [ACD/IUPAC Name]
Benzoic-2,3,5,6-d4 acid, 4-(acetylamino)- [ACD/Index Name]
1794786-68-7 [RN]
4-acetamido-2,3,5,6-tetradeuteriobenzoic acid
Acedoben-d4

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 439.6±28.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 73.4±3.0 kJ/mol
    Flash Point: 219.7±24.0 °C
    Index of Refraction: 1.620
    Molar Refractivity: 47.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.31
    ACD/LogD (pH 5.5): -0.12
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.23
    ACD/LogD (pH 7.4): -1.68
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 66 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 58.3±3.0 dyne/cm
    Molar Volume: 135.0±3.0 cm3

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