Found 2 results

Search term: XVEURJOWGBWEPY (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl 1-[(2,6-difluorophenyl)(~2~H_2_)methyl]-1H-1,2,3-triazole-4-carboxylate | C11H7D2F2N3O2

Methyl 1-[(2,6-difluorophenyl)(2H2)methyl]-1H-1,2,3-triazole-4-carboxylate

  • Molecular FormulaC11H7D2F2N3O2
  • Average mass255.217 Da
  • Monoisotopic mass255.078842 Da
  • ChemSpider ID48060730

  • Non-standard isotope - Non-standard isotope

More details:

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

1-[(2,6-Difluorophényl)(2H2)méthyl]-1H-1,2,3-triazole-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxylic acid, 1-[(2,6-difluorophenyl)methyl-d2]-, methyl ester [ACD/Index Name]
Methyl 1-[(2,6-difluorophenyl)(2H2)methyl]-1H-1,2,3-triazole-4-carboxylate [ACD/IUPAC Name]
Methyl-1-[(2,6-difluorphenyl)(2H2)methyl]-1H-1,2,3-triazol-4-carboxylat [German] [ACD/IUPAC Name]
1-(2,6-Difluorobenzyl)-1H-1,2,3-triazole-4-carboxylic Acid Methyl Ester-d2
1346597-78-1 [RN]
methyl 1-[dideuterio-(2,6-difluorophenyl)methyl]triazole-4-carboxylate

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 374.8±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.2±3.0 kJ/mol
    Flash Point: 180.5±30.7 °C
    Index of Refraction: 1.575
    Molar Refractivity: 60.0±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.51
    ACD/LogD (pH 5.5): 1.70
    ACD/BCF (pH 5.5): 11.52
    ACD/KOC (pH 5.5): 200.13
    ACD/LogD (pH 7.4): 1.70
    ACD/BCF (pH 7.4): 11.52
    ACD/KOC (pH 7.4): 200.13
    Polar Surface Area: 57 Å2
    Polarizability: 23.8±0.5 10-24cm3
    Surface Tension: 41.4±7.0 dyne/cm
    Molar Volume: 181.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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