ChemSpider 2D Image | 3-Bromo-1-{2-[(difluoromethyl)sulfonyl]phenyl}piperidine | C12H14BrF2NO2S

3-Bromo-1-{2-[(difluoromethyl)sulfonyl]phenyl}piperidine

  • Molecular FormulaC12H14BrF2NO2S
  • Average mass354.211 Da
  • Monoisotopic mass352.989655 Da
  • ChemSpider ID36313467

More details:

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

3-Brom-1-{2-[(difluormethyl)sulfonyl]phenyl}piperidin [German] [ACD/IUPAC Name]
3-Bromo-1-{2-[(difluoromethyl)sulfonyl]phenyl}piperidine [ACD/IUPAC Name]
3-Bromo-1-{2-[(difluorométhyl)sulfonyl]phényl}pipéridine [French] [ACD/IUPAC Name]
Piperidine, 3-bromo-1-[2-[(difluoromethyl)sulfonyl]phenyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 460.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 232.5±28.7 °C
Index of Refraction: 1.551
Molar Refractivity: 73.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 50.63
ACD/KOC (pH 5.5): 577.61
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 50.63
ACD/KOC (pH 7.4): 577.64
Polar Surface Area: 46 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 229.1±3.0 cm3

Click to predict properties on the Chemicalize site


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