Found 3 results

Search term: JFSNSJCTRPXCTA (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3R)-1-Benzyl-3-(4-fluorophenyl)pyrrolidine | C17H18FN

(3R)-1-Benzyl-3-(4-fluorophenyl)pyrrolidine

  • Molecular FormulaC17H18FN
  • Average mass255.330 Da
  • Monoisotopic mass255.142334 Da
  • ChemSpider ID96651727

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-1-Benzyl-3-(4-fluorophenyl)pyrrolidine [ACD/IUPAC Name]
(3R)-1-Benzyl-3-(4-fluorophényl)pyrrolidine [French] [ACD/IUPAC Name]
(3R)-1-Benzyl-3-(4-fluorphenyl)pyrrolidin [German] [ACD/IUPAC Name]
Pyrrolidine, 3-(4-fluorophenyl)-1-(phenylmethyl)-, (3R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 347.7±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.2±3.0 kJ/mol
Flash Point: 164.1±26.5 °C
Index of Refraction: 1.582
Molar Refractivity: 75.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.08
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 9.22
ACD/KOC (pH 7.4): 54.39
Polar Surface Area: 3 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 226.5±3.0 cm3

Click to predict properties on the Chemicalize site


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