ChemSpider 2D Image | 2-{4-[(Difluoromethyl)sulfonyl]phenyl}-2,2-difluoroethanamine | C9H9F4NO2S

2-{4-[(Difluoromethyl)sulfonyl]phenyl}-2,2-difluoroethanamine

  • Molecular FormulaC9H9F4NO2S
  • Average mass271.232 Da
  • Monoisotopic mass271.029022 Da
  • ChemSpider ID45924196

More details:

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

2-{4-[(Difluormethyl)sulfonyl]phenyl}-2,2-difluorethanamin [German] [ACD/IUPAC Name]
2-{4-[(Difluoromethyl)sulfonyl]phenyl}-2,2-difluoroethanamine [ACD/IUPAC Name]
2-{4-[(Difluorométhyl)sulfonyl]phényl}-2,2-difluoroéthanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 4-[(difluoromethyl)sulfonyl]-β,β-difluoro- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 393.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.4±3.0 kJ/mol
Flash Point: 191.9±27.9 °C
Index of Refraction: 1.473
Molar Refractivity: 53.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.55
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.36
ACD/KOC (pH 7.4): 127.33
Polar Surface Area: 69 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 190.7±3.0 cm3

Click to predict properties on the Chemicalize site


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