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Search term: 1133116-35-4 (Found by approved synonym)
ChemSpider 2D Image | 2-Bromo-1-methyl-4-(trifluoromethylsulfonyl)benzene | C8H6BrF3O2S

2-Bromo-1-methyl-4-(trifluoromethylsulfonyl)benzene

  • Molecular FormulaC8H6BrF3O2S
  • Average mass303.096 Da
  • Monoisotopic mass301.922394 Da
  • ChemSpider ID25949938

More details:

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

1133116-35-4 [RN]
2-Brom-1-methyl-4-[(trifluormethyl)sulfonyl]benzol [German] [ACD/IUPAC Name]
2-Bromo-1-methyl-4-(trifluoromethylsulfonyl)benzene
2-Bromo-1-methyl-4-[(trifluoromethyl)sulfonyl]benzene [ACD/IUPAC Name]
2-Bromo-1-méthyl-4-[(trifluorométhyl)sulfonyl]benzène [French] [ACD/IUPAC Name]
Benzene, 2-bromo-1-methyl-4-[(trifluoromethyl)sulfonyl]- [ACD/Index Name]
[1133116-35-4] [RN]
2-Bromo-1-methyl-4-((trifluoromethyl)sulfonyl)benzene
2-Bromo-1-methyl-4-((trifluoromethyl)-sulfonyl)benzene
2-Bromo-1-methyl-4-(trifluoromethanesulfonyl)benzene
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 315.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.5±3.0 kJ/mol
    Flash Point: 144.7±27.9 °C
    Index of Refraction: 1.499
    Molar Refractivity: 52.9±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 4.31
    ACD/LogD (pH 5.5): 3.99
    ACD/BCF (pH 5.5): 630.98
    ACD/KOC (pH 5.5): 3514.42
    ACD/LogD (pH 7.4): 3.99
    ACD/BCF (pH 7.4): 630.98
    ACD/KOC (pH 7.4): 3514.42
    Polar Surface Area: 43 Å2
    Polarizability: 21.0±0.5 10-24cm3
    Surface Tension: 34.5±3.0 dyne/cm
    Molar Volume: 180.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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