ChemSpider 2D Image | 3-(2-Chloro-4-fluorobenzyl)-6,7-dimethoxy-4(3H)-quinazolinone | C17H14ClFN2O3

3-(2-Chloro-4-fluorobenzyl)-6,7-dimethoxy-4(3H)-quinazolinone

  • Molecular FormulaC17H14ClFN2O3
  • Average mass348.756 Da
  • Monoisotopic mass348.067688 Da
  • ChemSpider ID22497912

More details:

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

3-(2-Chlor-4-fluorbenzyl)-6,7-dimethoxy-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
3-(2-Chloro-4-fluorobenzyl)-6,7-dimethoxy-4(3H)-quinazolinone [ACD/IUPAC Name]
3-(2-Chloro-4-fluorobenzyl)-6,7-diméthoxy-4(3H)-quinazolinone [French] [ACD/IUPAC Name]
4(3H)-Quinazolinone, 3-[(2-chloro-4-fluorophenyl)methyl]-6,7-dimethoxy- [ACD/Index Name]
1081118-70-8 [RN]
3-(2-Chloro-4-fluoro-benzyl)-6,7-dimethoxy-3H-quinazolin-4-one
3-(2-chloro-4-fluorobenzyl)-6,7-dimethoxyquinazolin-4(3H)-one
3-[(2-chloro-4-fluorophenyl)methyl]-6,7-dimethoxyquinazolin-4-one

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 518.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.1±3.0 kJ/mol
    Flash Point: 267.2±32.9 °C
    Index of Refraction: 1.601
    Molar Refractivity: 88.0±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.41
    ACD/LogD (pH 5.5): 3.09
    ACD/BCF (pH 5.5): 130.46
    ACD/KOC (pH 5.5): 1137.29
    ACD/LogD (pH 7.4): 3.09
    ACD/BCF (pH 7.4): 130.46
    ACD/KOC (pH 7.4): 1137.29
    Polar Surface Area: 51 Å2
    Polarizability: 34.9±0.5 10-24cm3
    Surface Tension: 43.1±7.0 dyne/cm
    Molar Volume: 257.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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