ChemSpider 2D Image | 1-[(4-Bromo-3-methylphenyl)sulfonyl]-4,4-difluoropiperidine | C12H14BrF2NO2S

1-[(4-Bromo-3-methylphenyl)sulfonyl]-4,4-difluoropiperidine

  • Molecular FormulaC12H14BrF2NO2S
  • Average mass354.211 Da
  • Monoisotopic mass352.989655 Da
  • ChemSpider ID69038649

More details:

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

1-[(4-Brom-3-methylphenyl)sulfonyl]-4,4-difluorpiperidin [German] [ACD/IUPAC Name]
1-[(4-Bromo-3-methylphenyl)sulfonyl]-4,4-difluoropiperidine [ACD/IUPAC Name]
1-[(4-Bromo-3-méthylphényl)sulfonyl]-4,4-difluoropipéridine [French] [ACD/IUPAC Name]
Piperidine, 1-[(4-bromo-3-methylphenyl)sulfonyl]-4,4-difluoro- [ACD/Index Name]
1-(4-Bromo-3-methylbenzenesulfonyl)-4,4-difluoropiperidine
1-(4-Bromo-3-methyl-benzenesulfonyl)-4,4-difluoro-piperidine
2216744-62-4 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 419.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 207.5±31.5 °C
Index of Refraction: 1.582
Molar Refractivity: 73.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 248.07
ACD/KOC (pH 5.5): 1801.51
ACD/LogD (pH 7.4): 3.45
ACD/BCF (pH 7.4): 248.07
ACD/KOC (pH 7.4): 1801.51
Polar Surface Area: 46 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 50.5±5.0 dyne/cm
Molar Volume: 219.2±5.0 cm3

Click to predict properties on the Chemicalize site


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