ChemSpider 2D Image | 4-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]benzoyl chloride | C10H6Cl2N2O2

4-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]benzoyl chloride

  • Molecular FormulaC10H6Cl2N2O2
  • Average mass257.073 Da
  • Monoisotopic mass255.980637 Da
  • ChemSpider ID21800353

More details:

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

1119450-88-2 [RN]
4-[5-(Chlormethyl)-1,2,4-oxadiazol-3-yl]benzoylchlorid [German] [ACD/IUPAC Name]
4-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]benzoyl chloride [ACD/IUPAC Name]
Benzoyl chloride, 4-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]- [ACD/Index Name]
Chlorure de 4-[5-(chlorométhyl)-1,2,4-oxadiazol-3-yl]benzoyle [French] [ACD/IUPAC Name]
4-(5-(chloromethyl)-1,2,4-oxadiazol-3-yl)benzoyl chloride
4-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]-benzoyl chloride

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

MFCD12026867 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 393.1±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.3±3.0 kJ/mol
    Flash Point: 191.5±30.7 °C
    Index of Refraction: 1.581
    Molar Refractivity: 59.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.93
    ACD/LogD (pH 5.5): 2.81
    ACD/BCF (pH 5.5): 79.98
    ACD/KOC (pH 5.5): 801.25
    ACD/LogD (pH 7.4): 2.81
    ACD/BCF (pH 7.4): 79.98
    ACD/KOC (pH 7.4): 801.25
    Polar Surface Area: 56 Å2
    Polarizability: 23.5±0.5 10-24cm3
    Surface Tension: 53.7±3.0 dyne/cm
    Molar Volume: 178.1±3.0 cm3

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