ChemSpider 2D Image | 1,3-Difluoro-5-(methylsulfonyl)benzene | C7H6F2O2S

1,3-Difluoro-5-(methylsulfonyl)benzene

  • Molecular FormulaC7H6F2O2S
  • Average mass192.183 Da
  • Monoisotopic mass192.005661 Da
  • ChemSpider ID25071159

More details:

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

1,3-Difluor-5-(methylsulfonyl)benzol [German] [ACD/IUPAC Name]
1,3-Difluoro-5-(methylsulfonyl)benzene [ACD/IUPAC Name]
1,3-Difluoro-5-(méthylsulfonyl)benzène [French] [ACD/IUPAC Name]
Benzene, 1,3-difluoro-5-(methylsulfonyl)- [ACD/Index Name]
[171421-55-9] [RN]
1 3-difluoro-5-methylsulfonylbenzene
1,3-Difluoro-5-(methanesulfonyl)benzene
1,3-Difluoro-5-methylsulfonylbenzene
171421-55-9 [RN]
98%
More...

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: 1.4±0.1 g/cm3
    Boiling Point: 303.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.2±3.0 kJ/mol
    Flash Point: 137.5±27.9 °C
    Index of Refraction: 1.491
    Molar Refractivity: 40.4±0.4 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): 1.30
    ACD/BCF (pH 5.5): 5.75
    ACD/KOC (pH 5.5): 121.76
    ACD/LogD (pH 7.4): 1.30
    ACD/BCF (pH 7.4): 5.75
    ACD/KOC (pH 7.4): 121.76
    Polar Surface Area: 43 Å2
    Polarizability: 16.0±0.5 10-24cm3
    Surface Tension: 34.3±3.0 dyne/cm
    Molar Volume: 139.6±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement