Found 207 results

Search term: MF = 'C_{8}H_{3}F_{3}N_{2}O_{2}'

ChemSpider 2D Image | 2-Nitro-5-(trifluoromethyl)benzonitrile | C8H3F3N2O2

2-Nitro-5-(trifluoromethyl)benzonitrile

  • Molecular FormulaC8H3F3N2O2
  • Average mass216.117 Da
  • Monoisotopic mass216.014664 Da
  • ChemSpider ID21468662

More details:






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

16499-52-8 [RN]
2-Nitro-5-(trifluormethyl)benzonitril [German] [ACD/IUPAC Name]
2-Nitro-5-(trifluoromethyl)benzonitrile [ACD/IUPAC Name]
2-Nitro-5-(trifluorométhyl)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-nitro-5-(trifluoromethyl)- [ACD/Index Name]
2-Cyano-4-(trifluoromethyl)nitrobenzene
2-Cyano-4-(trifluoromethyl)nitrobenzene, 2-Nitro-5-(trifluoromethyl)benzonitrile
2-Cyano-4-(trifluoromethyl)nitrobenzene; 2-Nitro-5-(trifluoromethyl)benzonitrile
2-nitro-5-(trifluoromethyl)benzenecarbonitrile
3-Cyano-4-nitrobenzotrifluoride
More...

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: 1.5±0.1 g/cm3
    Boiling Point: 304.3±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.5±3.0 kJ/mol
    Flash Point: 137.9±27.9 °C
    Index of Refraction: 1.499
    Molar Refractivity: 42.3±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.27
    ACD/LogD (pH 5.5): 2.48
    ACD/BCF (pH 5.5): 45.53
    ACD/KOC (pH 5.5): 535.36
    ACD/LogD (pH 7.4): 2.48
    ACD/BCF (pH 7.4): 45.53
    ACD/KOC (pH 7.4): 535.36
    Polar Surface Area: 70 Å2
    Polarizability: 16.8±0.5 10-24cm3
    Surface Tension: 44.3±5.0 dyne/cm
    Molar Volume: 144.3±5.0 cm3

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