ChemSpider 2D Image | 3-MCPD-D5 | C3H2D5ClO2

3-MCPD-D5

  • Molecular FormulaC3H2D5ClO2
  • Average mass115.570 Da
  • Monoisotopic mass115.044838 Da
  • ChemSpider ID24532329

  • Non-standard isotope - Non-standard isotope

More details:

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

1,2-Propane-1,1,2,3,3-d5-diol, 3-chloro- [ACD/Index Name]
342611-01-2 [RN]
3-Chlor-1,2-(2H5)propandiol [German] [ACD/IUPAC Name]
3-Chloro(2H5)propane-1,2-diol
3-Chloro-1,2-(2H5)propanediol [ACD/IUPAC Name]
3-Chloro-1,2-(2H5)propanediol [French] [ACD/IUPAC Name]
3-CHLORO-1,2-PROPANEDIOL-1,1,2,3,3-D5
3-MCPD-D5
MFCD01317355
(?)-3-Chloro-1,2-propane-d5-diol
More...

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 213.0±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 52.3±6.0 kJ/mol
    Flash Point: 113.3±21.8 °C
    Index of Refraction: 1.474
    Molar Refractivity: 23.8±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.76
    ACD/LogD (pH 5.5): -0.54
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 12.14
    ACD/LogD (pH 7.4): -0.54
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 12.14
    Polar Surface Area: 40 Å2
    Polarizability: 9.4±0.5 10-24cm3
    Surface Tension: 45.9±3.0 dyne/cm
    Molar Volume: 84.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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