ChemSpider 2D Image | N-Benzyl-N'-(3,5-dibromo-2-ethoxybenzyl)-N-methyl-1,3-propanediamine | C20H26Br2N2O

N-Benzyl-N'-(3,5-dibromo-2-ethoxybenzyl)-N-methyl-1,3-propanediamine

  • Molecular FormulaC20H26Br2N2O
  • Average mass470.241 Da
  • Monoisotopic mass468.041168 Da
  • ChemSpider ID53600509

More details:

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

1,3-Propanediamine, N3-[(3,5-dibromo-2-ethoxyphenyl)methyl]-N1-methyl-N1-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-N'-(3,5-dibrom-2-ethoxybenzyl)-N-methyl-1,3-propandiamin [German] [ACD/IUPAC Name]
N-Benzyl-N'-(3,5-dibromo-2-ethoxybenzyl)-N-methyl-1,3-propanediamine [ACD/IUPAC Name]
N-Benzyl-N'-(3,5-dibromo-2-éthoxybenzyl)-N-méthyl-1,3-propanediamine [French] [ACD/IUPAC Name]
benzyl(3-{[(3,5-dibromo-2-ethoxyphenyl)methyl]amino}propyl)methylamine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 498.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 255.1±28.7 °C
Index of Refraction: 1.582
Molar Refractivity: 112.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 5.81
ACD/LogD (pH 5.5): 1.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.10
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 99.56
ACD/KOC (pH 7.4): 257.40
Polar Surface Area: 25 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 337.9±3.0 cm3

Click to predict properties on the Chemicalize site


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