ChemSpider 2D Image | (2E)-[(2-Fluoro-5-methylphenyl)sulfonyl][(4-methylphenyl)hydrazono]acetonitrile | C16H14FN3O2S

(2E)-[(2-Fluoro-5-methylphenyl)sulfonyl][(4-methylphenyl)hydrazono]acetonitrile

  • Molecular FormulaC16H14FN3O2S
  • Average mass331.365 Da
  • Monoisotopic mass331.079071 Da
  • ChemSpider ID34968179
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-[(2-Fluor-5-methylphenyl)sulfonyl][(4-methylphenyl)hydrazono]acetonitril [German] [ACD/IUPAC Name]
(2E)-[(2-Fluoro-5-methylphenyl)sulfonyl][(4-methylphenyl)hydrazono]acetonitrile [ACD/IUPAC Name]
(2E)-[(2-Fluoro-5-méthylphényl)sulfonyl][(4-méthylphényl)hydrazono]acétonitrile [French] [ACD/IUPAC Name]
Acetonitrile, 2-[(2-fluoro-5-methylphenyl)sulfonyl]-2-[2-(4-methylphenyl)hydrazinylidene]-, (2E)- [ACD/Index Name]
(1E)-1-(2-fluoro-5-methylphenyl)sulfonyl-N-(4-methylanilino)methanimidoyl cyanide
(2-Fluoro-5-methyl-benzenesulfonyl)-(p-tolyl-hydrazono)-acetonitrile
(E)-1-((2-fluoro-5-methylphenyl)sulfonyl)-N'-(p-tolyl)methanehydrazonoyl cyanide
(E)-1-(2-fluoro-5-methylbenzenesulfonyl)-N-(4-methylphenyl)methanecarbohydrazonoyl cyanide
[1786040-94-5] [RN]
1786040-94-5 [RN]
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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: 484.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.9±3.0 kJ/mol
    Flash Point: 246.6±31.5 °C
    Index of Refraction: 1.594
    Molar Refractivity: 88.5±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.33
    ACD/LogD (pH 5.5): 2.90
    ACD/BCF (pH 5.5): 69.89
    ACD/KOC (pH 5.5): 510.67
    ACD/LogD (pH 7.4): 1.61
    ACD/BCF (pH 7.4): 3.60
    ACD/KOC (pH 7.4): 26.33
    Polar Surface Area: 91 Å2
    Polarizability: 35.1±0.5 10-24cm3
    Surface Tension: 45.0±7.0 dyne/cm
    Molar Volume: 260.8±7.0 cm3

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