ChemSpider 2D Image | (~2~H_7_)-2-Propanyl 4-hydroxybenzoate | C10H5D7O3

(2H7)-2-Propanyl 4-hydroxybenzoate

  • Molecular FormulaC10H5D7O3
  • Average mass187.244 Da
  • Monoisotopic mass187.122574 Da
  • ChemSpider ID48061024

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H7)-2-Propanyl 4-hydroxybenzoate [ACD/IUPAC Name]
(2H7)-2-Propanyl-4-hydroxybenzoat [German] [ACD/IUPAC Name]
4-Hydroxybenzoate de (2H7)-2-propanyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-hydroxy-, 1-(methyl-d3)ethyl-1,2,2,2-d4 ester [ACD/Index Name]
1,1,1,2,3,3,3-heptadeuteriopropan-2-yl 4-hydroxybenzoate
1432063-95-0 [RN]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 286.9±13.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.7±3.0 kJ/mol
    Flash Point: 120.4±12.6 °C
    Index of Refraction: 1.530
    Molar Refractivity: 49.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.74
    ACD/LogD (pH 5.5): 2.81
    ACD/BCF (pH 5.5): 80.26
    ACD/KOC (pH 5.5): 802.97
    ACD/LogD (pH 7.4): 2.77
    ACD/BCF (pH 7.4): 73.03
    ACD/KOC (pH 7.4): 730.67
    Polar Surface Area: 47 Å2
    Polarizability: 19.5±0.5 10-24cm3
    Surface Tension: 41.6±3.0 dyne/cm
    Molar Volume: 159.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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