ChemSpider 2D Image | 5-(Trifluoromethyl)-3-pyrrolidinesulfonyl chloride | C5H7ClF3NO2S

5-(Trifluoromethyl)-3-pyrrolidinesulfonyl chloride

  • Molecular FormulaC5H7ClF3NO2S
  • Average mass237.628 Da
  • Monoisotopic mass236.983810 Da
  • ChemSpider ID128923474

More details:

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

3-Pyrrolidinesulfonyl chloride, 5-(trifluoromethyl)- [ACD/Index Name]
5-(Trifluormethyl)-3-pyrrolidinsulfonylchlorid [German] [ACD/IUPAC Name]
5-(Trifluoromethyl)-3-pyrrolidinesulfonyl chloride [ACD/IUPAC Name]
Chlorure de 5-(trifluorométhyl)-3-pyrrolidinesulfonyle [French] [ACD/IUPAC Name]
1803571-48-3 [RN]
5-(Trifluoromethyl)-1H-pyrrole-3-sulfonyl chloride [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 254.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 107.8±27.3 °C
Index of Refraction: 1.458
Molar Refractivity: 40.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.36
ACD/LogD (pH 5.5): 0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.13
ACD/LogD (pH 7.4): 0.50
ACD/BCF (pH 7.4): 1.40
ACD/KOC (pH 7.4): 44.24
Polar Surface Area: 55 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 36.3±5.0 dyne/cm
Molar Volume: 149.6±5.0 cm3

Click to predict properties on the Chemicalize site


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