ChemSpider 2D Image | N,N-Dibenzyl-1-(3-chlorophenyl)ethanamine | C22H22ClN

N,N-Dibenzyl-1-(3-chlorophenyl)ethanamine

  • Molecular FormulaC22H22ClN
  • Average mass335.870 Da
  • Monoisotopic mass335.144073 Da
  • ChemSpider ID65326847

More details:

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

Benzenemethanamine, 3-chloro-α-methyl-N,N-bis(phenylmethyl)- [ACD/Index Name]
N,N-Dibenzyl-1-(3-chlorophenyl)ethanamine [ACD/IUPAC Name]
N,N-Dibenzyl-1-(3-chlorophényl)éthanamine [French] [ACD/IUPAC Name]
N,N-Dibenzyl-1-(3-chlorphenyl)ethanamin [German] [ACD/IUPAC Name]
(S)-N,N-Dibenzyl-1-(3-chlorophenyl)ethan-1-amine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 417.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.1±3.0 kJ/mol
Flash Point: 206.1±24.6 °C
Index of Refraction: 1.609
Molar Refractivity: 102.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.61
ACD/LogD (pH 5.5): 4.82
ACD/BCF (pH 5.5): 1395.42
ACD/KOC (pH 5.5): 2855.82
ACD/LogD (pH 7.4): 5.93
ACD/BCF (pH 7.4): 18079.18
ACD/KOC (pH 7.4): 37000.27
Polar Surface Area: 3 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 296.6±3.0 cm3

Click to predict properties on the Chemicalize site


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