ChemSpider 2D Image | N-(2,6-Difluorobenzyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide | C13H12F2N2OS

N-(2,6-Difluorobenzyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide

  • Molecular FormulaC13H12F2N2OS
  • Average mass282.309 Da
  • Monoisotopic mass282.063843 Da
  • ChemSpider ID30719317

More details:

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

5-Thiazolecarboxamide, N-[(2,6-difluorophenyl)methyl]-2,4-dimethyl- [ACD/Index Name]
N-(2,6-Difluorbenzyl)-2,4-dimethyl-1,3-thiazol-5-carboxamid [German] [ACD/IUPAC Name]
N-(2,6-Difluorobenzyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide [ACD/IUPAC Name]
N-(2,6-Difluorobenzyl)-2,4-diméthyl-1,3-thiazole-5-carboxamide [French] [ACD/IUPAC Name]
1574301-04-4 [RN]
2,4-Dimethyl-thiazole-5-carboxylic acid 2,6-difluoro-benzylamide
N-(2,6-difluorobenzyl)-2,4-dimethylthiazole-5-carboxamide
N-[(2,6-difluorophenyl)methyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 430.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.6±3.0 kJ/mol
    Flash Point: 214.3±28.7 °C
    Index of Refraction: 1.572
    Molar Refractivity: 70.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.43
    ACD/LogD (pH 5.5): 2.29
    ACD/BCF (pH 5.5): 32.22
    ACD/KOC (pH 5.5): 417.85
    ACD/LogD (pH 7.4): 2.29
    ACD/BCF (pH 7.4): 32.24
    ACD/KOC (pH 7.4): 418.12
    Polar Surface Area: 70 Å2
    Polarizability: 27.9±0.5 10-24cm3
    Surface Tension: 46.6±3.0 dyne/cm
    Molar Volume: 214.2±3.0 cm3

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