ChemSpider 2D Image | 2,4-Dichloro-7-(trifluoromethoxy)quinazoline | C9H3Cl2F3N2O

2,4-Dichloro-7-(trifluoromethoxy)quinazoline

  • Molecular FormulaC9H3Cl2F3N2O
  • Average mass283.034 Da
  • Monoisotopic mass281.957458 Da
  • ChemSpider ID23499375

More details:

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

1160994-83-1 [RN]
2,4-Dichlor-7-(trifluormethoxy)chinazolin [German] [ACD/IUPAC Name]
2,4-Dichloro-7-(trifluoromethoxy)quinazoline [ACD/IUPAC Name]
2,4-Dichloro-7-(trifluorométhoxy)quinazoline [French] [ACD/IUPAC Name]
Quinazoline, 2,4-dichloro-7-(trifluoromethoxy)- [ACD/Index Name]
[1160994-83-1] [RN]
MFCD12400771 [MDL number]

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

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 213.2±40.0 °C at 760 mmHg
    Vapour Pressure: 0.2±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 43.1±3.0 kJ/mol
    Flash Point: 82.7±27.3 °C
    Index of Refraction: 1.570
    Molar Refractivity: 57.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.90
    ACD/LogD (pH 5.5): 3.55
    ACD/BCF (pH 5.5): 294.62
    ACD/KOC (pH 5.5): 2037.53
    ACD/LogD (pH 7.4): 3.55
    ACD/BCF (pH 7.4): 294.62
    ACD/KOC (pH 7.4): 2037.53
    Polar Surface Area: 35 Å2
    Polarizability: 22.7±0.5 10-24cm3
    Surface Tension: 45.0±3.0 dyne/cm
    Molar Volume: 174.3±3.0 cm3

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