ChemSpider 2D Image | 1-{2-[(2-Chloro-6-fluorobenzyl)oxy]benzyl}-2-(ethoxymethyl)pyrrolidine | C21H25ClFNO2

1-{2-[(2-Chloro-6-fluorobenzyl)oxy]benzyl}-2-(ethoxymethyl)pyrrolidine

  • Molecular FormulaC21H25ClFNO2
  • Average mass377.880 Da
  • Monoisotopic mass377.155792 Da
  • ChemSpider ID62727593

More details:

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

1-{2-[(2-Chlor-6-fluorbenzyl)oxy]benzyl}-2-(ethoxymethyl)pyrrolidin [German] [ACD/IUPAC Name]
1-{2-[(2-Chloro-6-fluorobenzyl)oxy]benzyl}-2-(ethoxymethyl)pyrrolidine [ACD/IUPAC Name]
1-{2-[(2-Chloro-6-fluorobenzyl)oxy]benzyl}-2-(éthoxyméthyl)pyrrolidine [French] [ACD/IUPAC Name]
Pyrrolidine, 1-[[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methyl]-2-(ethoxymethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 446.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 224.0±27.3 °C
Index of Refraction: 1.558
Molar Refractivity: 102.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.15
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 5.36
ACD/KOC (pH 5.5): 16.64
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 115.03
ACD/KOC (pH 7.4): 356.71
Polar Surface Area: 22 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 319.4±3.0 cm3

Click to predict properties on the Chemicalize site


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