ChemSpider 2D Image | 4-Cyano-3,5-difluorophenyl 4-propylbenzoate | C17H13F2NO2

4-Cyano-3,5-difluorophenyl 4-propylbenzoate

  • Molecular FormulaC17H13F2NO2
  • Average mass301.287 Da
  • Monoisotopic mass301.091431 Da
  • ChemSpider ID19248651

More details:

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

193275-43-3 [RN]
4-Cyan-3,5-difluorphenyl-4-propylbenzoat [German] [ACD/IUPAC Name]
4-Cyano-3,5-difluorophenyl 4-propylbenzoate [ACD/IUPAC Name]
4-Cyano-3,5-difluorophenyl 4-propyl-benzoate
4-Propylbenzoate de 4-cyano-3,5-difluorophényle [French] [ACD/IUPAC Name]
Benzoic acid, 4-propyl-, 4-cyano-3,5-difluorophenyl ester [ACD/Index Name]
4-CYANO-3,5-DIFLUOROPHENYL4-PROPYL-BENZOATE
4-Propyl-benzoic acid 4-cyano-3,5-difluoro-phenyl ester
BENZOIC ACID,4-PROPYL-, 4-CYANO-3,5-DIFLUOROPHENYL ESTER
MFCD11053373

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 416.7±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.0±3.0 kJ/mol
    Flash Point: 205.8±28.7 °C
    Index of Refraction: 1.559
    Molar Refractivity: 76.6±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 5.47
    ACD/LogD (pH 5.5): 4.99
    ACD/BCF (pH 5.5): 3626.30
    ACD/KOC (pH 5.5): 12287.34
    ACD/LogD (pH 7.4): 4.99
    ACD/BCF (pH 7.4): 3626.30
    ACD/KOC (pH 7.4): 12287.34
    Polar Surface Area: 50 Å2
    Polarizability: 30.4±0.5 10-24cm3
    Surface Tension: 47.6±5.0 dyne/cm
    Molar Volume: 237.5±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement