ChemSpider 2D Image | Aspirin-d4 | C9H4D4O4

Aspirin-d4

  • Molecular FormulaC9H4D4O4
  • Average mass184.182 Da
  • Monoisotopic mass184.067368 Da
  • ChemSpider ID23977226
  • Non-standard isotope - Non-standard isotope


More details:






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

2-Acetoxy(2H4)benzoesäure [German] [ACD/IUPAC Name]
2-Acetoxy(2H4)benzoic acid [ACD/IUPAC Name]
2-Acetoxybenzoic-3,4,5,6-d4 Acid
6-(acetyloxy)-benzoic-2,3,4,5-d4 acid
97781-16-3 [RN]
Acetylsalicylic Acid-d4
Acetylsalycilic acid
Acide 2-acétoxy(2H4)benzoïque [French] [ACD/IUPAC Name]
Aspirin-d4
Benzoic-2,3,4,5-d4 acid, 6-(acetyloxy)- [ACD/Index Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

    Density: 1.3±0.1 g/cm3
    Boiling Point: 321.4±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 59.5±3.0 kJ/mol
    Flash Point: 131.2±16.7 °C
    Index of Refraction: 1.551
    Molar Refractivity: 44.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.19
    ACD/LogD (pH 5.5): -0.60
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.39
    ACD/LogD (pH 7.4): -1.69
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 64 Å2
    Polarizability: 17.7±0.5 10-24cm3
    Surface Tension: 49.9±3.0 dyne/cm
    Molar Volume: 139.6±3.0 cm3

    Click to predict properties on the Chemicalize site






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