ChemSpider 2D Image | 1-(Propylamino)-3-(2,4,6-tribromophenoxy)-2-propanol | C12H16Br3NO2

1-(Propylamino)-3-(2,4,6-tribromophenoxy)-2-propanol

  • Molecular FormulaC12H16Br3NO2
  • Average mass445.973 Da
  • Monoisotopic mass442.873108 Da
  • ChemSpider ID38107984

More details:

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

1-(Propylamino)-3-(2,4,6-tribromophenoxy)-2-propanol [ACD/IUPAC Name]
1-(Propylamino)-3-(2,4,6-tribromophénoxy)-2-propanol [French] [ACD/IUPAC Name]
1-(Propylamino)-3-(2,4,6-tribromphenoxy)-2-propanol [German] [ACD/IUPAC Name]
2-Propanol, 1-(propylamino)-3-(2,4,6-tribromophenoxy)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 485.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 247.6±28.7 °C
Index of Refraction: 1.586
Molar Refractivity: 84.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.47
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 11.15
ACD/KOC (pH 7.4): 54.85
Polar Surface Area: 41 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 251.2±3.0 cm3

Click to predict properties on the Chemicalize site


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