ChemSpider 2D Image | N-(2-Bromo-4-chlorobenzyl)-2-methyl-1-(4-pyridinyl)-1-propanamine | C16H18BrClN2

N-(2-Bromo-4-chlorobenzyl)-2-methyl-1-(4-pyridinyl)-1-propanamine

  • Molecular FormulaC16H18BrClN2
  • Average mass353.685 Da
  • Monoisotopic mass352.034180 Da
  • ChemSpider ID30382233

More details:

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

4-Pyridinemethanamine, N-[(2-bromo-4-chlorophenyl)methyl]-α-(1-methylethyl)- [ACD/Index Name]
N-(2-Brom-4-chlorbenzyl)-2-methyl-1-(4-pyridinyl)-1-propanamin [German] [ACD/IUPAC Name]
N-(2-Bromo-4-chlorobenzyl)-2-methyl-1-(4-pyridinyl)-1-propanamine [ACD/IUPAC Name]
N-(2-Bromo-4-chlorobenzyl)-2-méthyl-1-(4-pyridinyl)-1-propanamine [French] [ACD/IUPAC Name]
[(2-BROMO-4-CHLOROPHENYL)METHYL][2-METHYL-1-(PYRIDIN-4-YL)PROPYL]AMINE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 428.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.3±3.0 kJ/mol
Flash Point: 212.8±27.3 °C
Index of Refraction: 1.585
Molar Refractivity: 88.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 110.67
ACD/KOC (pH 5.5): 434.92
ACD/LogD (pH 7.4): 4.60
ACD/BCF (pH 7.4): 1764.62
ACD/KOC (pH 7.4): 6934.74
Polar Surface Area: 25 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 44.1±3.0 dyne/cm
Molar Volume: 263.8±3.0 cm3

Click to predict properties on the Chemicalize site


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