ChemSpider 2D Image | N-[1-Methoxy-3-(2,4,6-tribromophenoxy)-2-propanyl]-1-propanamine | C13H18Br3NO2

N-[1-Methoxy-3-(2,4,6-tribromophenoxy)-2-propanyl]-1-propanamine

  • Molecular FormulaC13H18Br3NO2
  • Average mass460.000 Da
  • Monoisotopic mass456.888733 Da
  • ChemSpider ID55782360

More details:

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

1-Propanamine, N-[2-methoxy-1-[(2,4,6-tribromophenoxy)methyl]ethyl]- [ACD/Index Name]
N-[1-Methoxy-3-(2,4,6-tribromophenoxy)-2-propanyl]-1-propanamine [ACD/IUPAC Name]
N-[1-Méthoxy-3-(2,4,6-tribromophénoxy)-2-propanyl]-1-propanamine [French] [ACD/IUPAC Name]
N-[1-Methoxy-3-(2,4,6-tribromphenoxy)-2-propanyl]-1-propanamin [German] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 440.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.8±3.0 kJ/mol
Flash Point: 220.5±28.7 °C
Index of Refraction: 1.557
Molar Refractivity: 89.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.82
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 8.49
ACD/KOC (pH 5.5): 30.64
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 423.10
ACD/KOC (pH 7.4): 1526.94
Polar Surface Area: 30 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 276.6±3.0 cm3

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