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Search term: MSYGBWPPRVPMSJ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2R)-2-(4-Fluorophenyl)-1-[(4-fluorophenyl)sulfonyl]pyrrolidine | C16H15F2NO2S

(2R)-2-(4-Fluorophenyl)-1-[(4-fluorophenyl)sulfonyl]pyrrolidine

  • Molecular FormulaC16H15F2NO2S
  • Average mass323.358 Da
  • Monoisotopic mass323.079163 Da
  • ChemSpider ID58919816

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-(4-Fluorophenyl)-1-[(4-fluorophenyl)sulfonyl]pyrrolidine [ACD/IUPAC Name]
(2R)-2-(4-Fluorophényl)-1-[(4-fluorophényl)sulfonyl]pyrrolidine [French] [ACD/IUPAC Name]
(2R)-2-(4-Fluorphenyl)-1-[(4-fluorphenyl)sulfonyl]pyrrolidin [German] [ACD/IUPAC Name]
Pyrrolidine, 2-(4-fluorophenyl)-1-[(4-fluorophenyl)sulfonyl]-, (2R)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 439.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 219.4±31.5 °C
Index of Refraction: 1.590
Molar Refractivity: 80.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 210.59
ACD/KOC (pH 5.5): 1602.23
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 210.59
ACD/KOC (pH 7.4): 1602.23
Polar Surface Area: 46 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 239.6±3.0 cm3

Click to predict properties on the Chemicalize site


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