ChemSpider 2D Image | 4-chloro-3-(chloromethyl)-1-methylpyrazole | C5H6Cl2N2

4-chloro-3-(chloromethyl)-1-methylpyrazole

  • Molecular FormulaC5H6Cl2N2
  • Average mass165.020 Da
  • Monoisotopic mass163.990799 Da
  • ChemSpider ID28604680

More details:

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

1429418-75-6 [RN]
1H-Pyrazole, 4-chloro-3-(chloromethyl)-1-methyl- [ACD/Index Name]
4-Chlor-3-(chlormethyl)-1-methyl-1H-pyrazol [German] [ACD/IUPAC Name]
4-Chloro-3-(chloromethyl)-1-methyl-1H-pyrazole [ACD/IUPAC Name]
4-Chloro-3-(chlorométhyl)-1-méthyl-1H-pyrazole [French] [ACD/IUPAC Name]
4-chloro-3-(chloromethyl)-1-methylpyrazole
4-Chloro-3-chloromethyl-1-methyl-1H-pyrazole
AKOS024273217
MFCD24540504
SCHEMBL16039441

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 252.4±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.0±3.0 kJ/mol
    Flash Point: 106.4±23.2 °C
    Index of Refraction: 1.579
    Molar Refractivity: 39.1±0.5 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.38
    ACD/LogD (pH 5.5): 2.08
    ACD/BCF (pH 5.5): 22.49
    ACD/KOC (pH 5.5): 323.09
    ACD/LogD (pH 7.4): 2.08
    ACD/BCF (pH 7.4): 22.49
    ACD/KOC (pH 7.4): 323.09
    Polar Surface Area: 18 Å2
    Polarizability: 15.5±0.5 10-24cm3
    Surface Tension: 40.6±7.0 dyne/cm
    Molar Volume: 117.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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