ChemSpider 2D Image | 2,3-Bis[(~2~H_3_)methyloxy]benzaldehyde | C9H4D6O3

2,3-Bis[(2H3)methyloxy]benzaldehyde

  • Molecular FormulaC9H4D6O3
  • Average mass172.211 Da
  • Monoisotopic mass172.100662 Da
  • ChemSpider ID48060093

  • Non-standard isotope - Non-standard isotope

More details:

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

2,3-Bis[(2H3)methyloxy]benzaldehyd [German] [ACD/IUPAC Name]
2,3-Bis[(2H3)methyloxy]benzaldehyde [ACD/IUPAC Name]
2,3-Bis[(2H3)méthyloxy]benzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde, 2,3-bis(methyl-d3-oxy)- [ACD/Index Name]
105258-77-3 [RN]
2,3-bis(trideuteriomethoxy)benzaldehyde
2,3-dimethoxybenzaldehyde-d6

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 266.7±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.5±3.0 kJ/mol
    Flash Point: 105.8±8.2 °C
    Index of Refraction: 1.534
    Molar Refractivity: 46.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.63
    ACD/LogD (pH 5.5): 1.34
    ACD/BCF (pH 5.5): 6.14
    ACD/KOC (pH 5.5): 127.61
    ACD/LogD (pH 7.4): 1.34
    ACD/BCF (pH 7.4): 6.14
    ACD/KOC (pH 7.4): 127.61
    Polar Surface Area: 36 Å2
    Polarizability: 18.4±0.5 10-24cm3
    Surface Tension: 36.2±3.0 dyne/cm
    Molar Volume: 149.1±3.0 cm3

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