ChemSpider 2D Image | (2E)-N-(3-Chloro-2-methylphenyl)-2-cyano-3-[3,5-dibromo-4-(2-propyn-1-yloxy)phenyl]acrylamide | C20H13Br2ClN2O2

(2E)-N-(3-Chloro-2-methylphenyl)-2-cyano-3-[3,5-dibromo-4-(2-propyn-1-yloxy)phenyl]acrylamide

  • Molecular FormulaC20H13Br2ClN2O2
  • Average mass508.590 Da
  • Monoisotopic mass505.903229 Da
  • ChemSpider ID12812002

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-(3-Chlor-2-methylphenyl)-2-cyan-3-[3,5-dibrom-4-(2-propin-1-yloxy)phenyl]acrylamid [German] [ACD/IUPAC Name]
(2E)-N-(3-Chloro-2-methylphenyl)-2-cyano-3-[3,5-dibromo-4-(2-propyn-1-yloxy)phenyl]acrylamide [ACD/IUPAC Name]
(2E)-N-(3-Chloro-2-méthylphényl)-2-cyano-3-[3,5-dibromo-4-(2-propyn-1-yloxy)phényl]acrylamide [French] [ACD/IUPAC Name]
(2E)-N-(3-Chloro-2-methylphenyl)-2-cyano-3-[3,5-dibromo-4-(prop-2-yn-1-yloxy)phenyl]acrylamide
2-Propenamide, N-(3-chloro-2-methylphenyl)-2-cyano-3-[3,5-dibromo-4-(2-propyn-1-yloxy)phenyl]-, (2E)- [ACD/Index Name]
(2E)-N-(3-chloro-2-methylphenyl)-2-cyano-3-[3,5-dibromo-4-(prop-2-yn-1-yloxy)phenyl]prop-2-enamide
(E)-N-(3-chloro-2-methylphenyl)-2-cyano-3-(3,5-dibromo-4-prop-2-ynoxyphenyl)prop-2-enamide
767318-57-0 [RN]
N-(3-Chloro-2-methyl-phenyl)-2-cyano-3-(3,5-dibromo-4-prop-2-ynyloxy-phenyl)-acrylamide
N-(3-chloro-2-methylphenyl)-2-cyano-3-[3,5-dibromo-4-(2-propynyloxy)phenyl]acrylamide

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 648.3±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.6±3.0 kJ/mol
    Flash Point: 345.9±31.5 °C
    Index of Refraction: 1.682
    Molar Refractivity: 114.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 5.95
    ACD/LogD (pH 5.5): 5.85
    ACD/BCF (pH 5.5): 16316.25
    ACD/KOC (pH 5.5): 36056.05
    ACD/LogD (pH 7.4): 5.84
    ACD/BCF (pH 7.4): 16292.29
    ACD/KOC (pH 7.4): 36003.13
    Polar Surface Area: 62 Å2
    Polarizability: 45.4±0.5 10-24cm3
    Surface Tension: 60.5±3.0 dyne/cm
    Molar Volume: 302.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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