ChemSpider 2D Image | N-Benzyl-N'-(4-iodobenzyl)-N-methyl-1,3-propanediamine | C18H23IN2

N-Benzyl-N'-(4-iodobenzyl)-N-methyl-1,3-propanediamine

  • Molecular FormulaC18H23IN2
  • Average mass394.293 Da
  • Monoisotopic mass394.090576 Da
  • ChemSpider ID48816396

More details:

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

1,3-Propanediamine, N3-[(4-iodophenyl)methyl]-N1-methyl-N1-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-N'-(4-iodbenzyl)-N-methyl-1,3-propandiamin [German] [ACD/IUPAC Name]
N-Benzyl-N'-(4-iodobenzyl)-N-methyl-1,3-propanediamine [ACD/IUPAC Name]
N-Benzyl-N'-(4-iodobenzyl)-N-méthyl-1,3-propanediamine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 427.8±35.0 °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: 212.6±25.9 °C
Index of Refraction: 1.606
Molar Refractivity: 99.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.84
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.66
ACD/BCF (pH 7.4): 2.91
ACD/KOC (pH 7.4): 15.90
Polar Surface Area: 15 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 287.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement