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Search term: MF = 'C_{19}H_{19}FN_{2}'
ChemSpider 2D Image | 3-[(2-Benzyl-1-pyrrolidinyl)methyl]-2-fluorobenzonitrile | C19H19FN2

3-[(2-Benzyl-1-pyrrolidinyl)methyl]-2-fluorobenzonitrile

  • Molecular FormulaC19H19FN2
  • Average mass294.366 Da
  • Monoisotopic mass294.153229 Da
  • ChemSpider ID30405154

More details:

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

3-[(2-Benzyl-1-pyrrolidinyl)methyl]-2-fluorbenzonitril [German] [ACD/IUPAC Name]
3-[(2-Benzyl-1-pyrrolidinyl)methyl]-2-fluorobenzonitrile [ACD/IUPAC Name]
3-[(2-Benzyl-1-pyrrolidinyl)méthyl]-2-fluorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-fluoro-3-[[2-(phenylmethyl)-1-pyrrolidinyl]methyl]- [ACD/Index Name]
3-[(2-BENZYLPYRROLIDIN-1-YL)METHYL]-2-FLUOROBENZONITRILE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 410.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.3±3.0 kJ/mol
Flash Point: 202.0±24.6 °C
Index of Refraction: 1.599
Molar Refractivity: 85.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.93
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 18.29
ACD/KOC (pH 7.4): 89.85
Polar Surface Area: 27 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 50.1±5.0 dyne/cm
Molar Volume: 251.0±5.0 cm3

Click to predict properties on the Chemicalize site


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