ChemSpider 2D Image | 3,4-Dibromo-2,5-dimethyl-1-(phenylsulfonyl)-1H-pyrrole | C12H11Br2NO2S

3,4-Dibromo-2,5-dimethyl-1-(phenylsulfonyl)-1H-pyrrole

  • Molecular FormulaC12H11Br2NO2S
  • Average mass393.094 Da
  • Monoisotopic mass390.887695 Da
  • ChemSpider ID30656906

More details:

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

1H-Pyrrole, 3,4-dibromo-2,5-dimethyl-1-(phenylsulfonyl)- [ACD/Index Name]
3,4-Dibrom-2,5-dimethyl-1-(phenylsulfonyl)-1H-pyrrol [German] [ACD/IUPAC Name]
3,4-Dibromo-2,5-dimethyl-1-(phenylsulfonyl)-1H-pyrrole [ACD/IUPAC Name]
3,4-Dibromo-2,5-diméthyl-1-(phénylsulfonyl)-1H-pyrrole [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 493.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.3±31.5 °C
Index of Refraction: 1.648
Molar Refractivity: 81.2±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.60
ACD/LogD (pH 5.5): 4.02
ACD/BCF (pH 5.5): 664.48
ACD/KOC (pH 5.5): 3647.00
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 664.48
ACD/KOC (pH 7.4): 3647.00
Polar Surface Area: 47 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 223.3±7.0 cm3

Click to predict properties on the Chemicalize site


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