ChemSpider 2D Image | 1-(4-Amino-3,5-dibromophenyl)-2-{[2-(~2~H_3_)methyl(~2~H_6_)-2-propanyl]amino}ethanol | C12H9D9Br2N2O

1-(4-Amino-3,5-dibromophenyl)-2-{[2-(2H3)methyl(2H6)-2-propanyl]amino}ethanol

  • Molecular FormulaC12H9D9Br2N2O
  • Average mass375.148 Da
  • Monoisotopic mass373.035065 Da
  • ChemSpider ID115006661

  • Non-standard isotope - Non-standard isotope

More details:

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

1-(4-Amino-3,5-dibromophenyl)-2-{[2-(2H3)methyl(2H6)-2-propanyl]amino}ethanol [ACD/IUPAC Name]
1-(4-Amino-3,5-dibromophényl)-2-{[2-(2H3)méthyl(2H6)-2-propanyl]amino}éthanol [French] [ACD/IUPAC Name]
1-(4-Amino-3,5-dibromphenyl)-2-{[2-(2H3)methyl(2H6)-2-propanyl]amino}ethanol [German] [ACD/IUPAC Name]
Benzenemethanol, 4-amino-3,5-dibromo-α-[[[1,1-di(methyl-d3)ethyl-2,2,2-d3]amino]methyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 456.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.5±3.0 kJ/mol
Flash Point: 229.7±27.3 °C
Index of Refraction: 1.603
Molar Refractivity: 79.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.53
Polar Surface Area: 58 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 48.9±3.0 dyne/cm
Molar Volume: 230.0±3.0 cm3

Click to predict properties on the Chemicalize site


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