ChemSpider 2D Image | 1-(2-Ethoxyphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid | C13H15N3O4

1-(2-Ethoxyphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid

  • Molecular FormulaC13H15N3O4
  • Average mass277.276 Da
  • Monoisotopic mass277.106262 Da
  • ChemSpider ID25932816

More details:

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

1-(2-Ethoxyphenyl)-5-(methoxymethyl)-1H-1,2,3-triazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-(2-Ethoxyphenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxylic acid, 1-(2-ethoxyphenyl)-5-(methoxymethyl)- [ACD/Index Name]
Acide 1-(2-éthoxyphényl)-5-(méthoxyméthyl)-1H-1,2,3-triazole-4-carboxylique [French] [ACD/IUPAC Name]
[1267198-01-5] [RN]
1-(2-ethoxyphenyl)-5-(methoxymethyl)triazole-4-carboxylic acid
1-(2-Ethoxy-phenyl)-5-methoxymethyl-1H-[1,2,3]triazole-4-carboxylic acid
1267198-01-5 [RN]
AGN-PC-09QTSM
AKOS005740020
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 477.4±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.1±3.0 kJ/mol
    Flash Point: 242.5±31.5 °C
    Index of Refraction: 1.594
    Molar Refractivity: 71.5±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.66
    ACD/LogD (pH 5.5): -0.45
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.27
    ACD/LogD (pH 7.4): -1.30
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 86 Å2
    Polarizability: 28.4±0.5 10-24cm3
    Surface Tension: 47.9±7.0 dyne/cm
    Molar Volume: 210.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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