ChemSpider 2D Image | 2-(3,5-Dichlorophenyl)-1,3-benzoxazole | C13H7Cl2NO

2-(3,5-Dichlorophenyl)-1,3-benzoxazole

  • Molecular FormulaC13H7Cl2NO
  • Average mass264.107 Da
  • Monoisotopic mass262.990479 Da
  • ChemSpider ID23309898

More details:

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

172944-87-5 [RN]
2-(3,5-Dichlorophenyl)-1,3-benzoxazole [ACD/IUPAC Name]
2-(3,5-Dichlorophényl)-1,3-benzoxazole [French] [ACD/IUPAC Name]
2-(3,5-Dichlorphenyl)-1,3-benzoxazol [German] [ACD/IUPAC Name]
Benzoxazole, 2-(3,5-dichlorophenyl)- [ACD/Index Name]
2-(3,5-dichlorophenyl)benzo[d]oxazole
2-(3,5-Dichloro-phenyl)-benzooxazole
AKOS025127825
CHEMBL402051
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL402051/
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 368.7±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.1±3.0 kJ/mol
    Flash Point: 176.8±25.1 °C
    Index of Refraction: 1.650
    Molar Refractivity: 68.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 1
    ACD/LogP: 5.62
    ACD/LogD (pH 5.5): 4.91
    ACD/BCF (pH 5.5): 3190.24
    ACD/KOC (pH 5.5): 11210.63
    ACD/LogD (pH 7.4): 4.91
    ACD/BCF (pH 7.4): 3190.29
    ACD/KOC (pH 7.4): 11210.78
    Polar Surface Area: 26 Å2
    Polarizability: 27.3±0.5 10-24cm3
    Surface Tension: 51.0±3.0 dyne/cm
    Molar Volume: 188.8±3.0 cm3

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