ChemSpider 2D Image | benzyl[3-(2-chlorophenyl)propyl]amine | C16H18ClN

benzyl[3-(2-chlorophenyl)propyl]amine

  • Molecular FormulaC16H18ClN
  • Average mass259.774 Da
  • Monoisotopic mass259.112762 Da
  • ChemSpider ID21330420

More details:

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

566913-11-9 [RN]
Benzenepropanamine, 2-chloro-N-(phenylmethyl)- [ACD/Index Name]
benzyl[3-(2-chlorophenyl)propyl]amine
N-Benzyl-3-(2-chlorophenyl)-1-propanamine [ACD/IUPAC Name]
N-Benzyl-3-(2-chlorophényl)-1-propanamine [French] [ACD/IUPAC Name]
N-Benzyl-3-(2-chlorphenyl)-1-propanamin [German] [ACD/IUPAC Name]
MFCD10687651 [MDL number]
N-benzyl-3-(2-chlorophenyl)propan-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: 376.9±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 181.7±24.6 °C
Index of Refraction: 1.573
Molar Refractivity: 78.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 1.17
ACD/KOC (pH 5.5): 5.29
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 11.24
ACD/KOC (pH 7.4): 50.89
Polar Surface Area: 12 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 236.7±3.0 cm3

Click to predict properties on the Chemicalize site


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