ChemSpider 2D Image | 2-(Chloromethyl)-1-nitro-3-(trifluoromethyl)benzene | C8H5ClF3NO2

2-(Chloromethyl)-1-nitro-3-(trifluoromethyl)benzene

  • Molecular FormulaC8H5ClF3NO2
  • Average mass239.579 Da
  • Monoisotopic mass238.996094 Da
  • ChemSpider ID24583678

More details:

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

2-(Chlormethyl)-1-nitro-3-(trifluormethyl)benzol [German] [ACD/IUPAC Name]
2-(Chloromethyl)-1-nitro-3-(trifluoromethyl)benzene [ACD/IUPAC Name]
2-(Chlorométhyl)-1-nitro-3-(trifluorométhyl)benzène [French] [ACD/IUPAC Name]
Benzene, 2-(chloromethyl)-1-nitro-3-(trifluoromethyl)- [ACD/Index Name]
[1227582-39-9] [RN]
1227582-39-9 [RN]
2-Nitro-6-(trifluoromethyl)benzyl chloride
2-nitro-6-TrifluoroMethylbenzyl chloride
MFCD16606364 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 240.6±35.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 45.8±3.0 kJ/mol
    Flash Point: 99.3±25.9 °C
    Index of Refraction: 1.497
    Molar Refractivity: 47.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.89
    ACD/LogD (pH 5.5): 3.06
    ACD/BCF (pH 5.5): 124.44
    ACD/KOC (pH 5.5): 1099.44
    ACD/LogD (pH 7.4): 3.06
    ACD/BCF (pH 7.4): 124.44
    ACD/KOC (pH 7.4): 1099.44
    Polar Surface Area: 46 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 35.0±3.0 dyne/cm
    Molar Volume: 162.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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