ChemSpider 2D Image | N-(3-Bromo-4-fluorophenyl)methanesulfonamide | C7H7BrFNO2S

N-(3-Bromo-4-fluorophenyl)methanesulfonamide

  • Molecular FormulaC7H7BrFNO2S
  • Average mass268.103 Da
  • Monoisotopic mass266.936493 Da
  • ChemSpider ID26051334

More details:

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

1256633-26-7 [RN]
Methanesulfonamide, N-(3-bromo-4-fluorophenyl)- [ACD/Index Name]
N-(3-Brom-4-fluorphenyl)methansulfonamid [German] [ACD/IUPAC Name]
N-(3-Bromo-4-fluorophenyl)methanesulfonamide [ACD/IUPAC Name]
N-(3-Bromo-4-fluorophényl)méthanesulfonamide [French] [ACD/IUPAC Name]
(3-bromo-4-pyridinyl)methanamine
(3-bromo-4-pyridyl)methanamine;4-(Aminomethyl)-3-bromopyridine
[1256633-26-7] [RN]
95%
MFCD18071053 [MDL number]
More...

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 323.8±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.6±3.0 kJ/mol
    Flash Point: 149.6±30.7 °C
    Index of Refraction: 1.604
    Molar Refractivity: 51.7±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.66
    ACD/LogD (pH 5.5): 1.91
    ACD/BCF (pH 5.5): 16.50
    ACD/KOC (pH 5.5): 254.78
    ACD/LogD (pH 7.4): 1.21
    ACD/BCF (pH 7.4): 3.24
    ACD/KOC (pH 7.4): 50.10
    Polar Surface Area: 55 Å2
    Polarizability: 20.5±0.5 10-24cm3
    Surface Tension: 53.7±3.0 dyne/cm
    Molar Volume: 150.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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