ChemSpider 2D Image | 4,6,7-Trichloroquinazoline | C8H3Cl3N2

4,6,7-Trichloroquinazoline

  • Molecular FormulaC8H3Cl3N2
  • Average mass233.482 Da
  • Monoisotopic mass231.936188 Da
  • ChemSpider ID28542120

More details:

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

4,6,7-Trichlorchinazolin [German] [ACD/IUPAC Name]
4,6,7-Trichloroquinazoline [ACD/IUPAC Name]
4,6,7-Trichloroquinazoline [French] [ACD/IUPAC Name]
57940-05-3 [RN]
Quinazoline, 4,6,7-trichloro- [ACD/Index Name]
"4,6,7-TRICHLOROQUINAZOLINE"
MFCD11044652
Quinazoline, 4,?6,?7-?trichloro-

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 342.0±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.3±3.0 kJ/mol
    Flash Point: 191.3±12.1 °C
    Index of Refraction: 1.678
    Molar Refractivity: 55.0±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 3.11
    ACD/LogD (pH 5.5): 3.37
    ACD/BCF (pH 5.5): 214.50
    ACD/KOC (pH 5.5): 1623.45
    ACD/LogD (pH 7.4): 3.37
    ACD/BCF (pH 7.4): 214.50
    ACD/KOC (pH 7.4): 1623.46
    Polar Surface Area: 26 Å2
    Polarizability: 21.8±0.5 10-24cm3
    Surface Tension: 60.6±3.0 dyne/cm
    Molar Volume: 145.8±3.0 cm3

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