ChemSpider 2D Image | 2-(3-Bromophenyl)-N-methylethanamine | C9H12BrN

2-(3-Bromophenyl)-N-methylethanamine

  • Molecular FormulaC9H12BrN
  • Average mass214.102 Da
  • Monoisotopic mass213.015305 Da
  • ChemSpider ID24696382

More details:

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

2-(3-Bromophenyl)-N-methylethanamine [ACD/IUPAC Name]
2-(3-Bromophényl)-N-méthyléthanamine [French] [ACD/IUPAC Name]
2-(3-Bromphenyl)-N-methylethanamin [German] [ACD/IUPAC Name]
Benzeneethanamine, 3-bromo-N-methyl- [ACD/Index Name]
[2-(3-bromophenyl)ethyl](methyl)amine
[2-(3-bromophenyl)ethyl]methylamine
[785032-26-0] [RN]
3-Bromo-N-methyl-benzeneethanamine
785032-26-0 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL476750/
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 264.8±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.3±3.0 kJ/mol
    Flash Point: 113.9±20.4 °C
    Index of Refraction: 1.544
    Molar Refractivity: 51.7±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.37
    ACD/LogD (pH 5.5): -0.37
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.77
    Polar Surface Area: 12 Å2
    Polarizability: 20.5±0.5 10-24cm3
    Surface Tension: 36.4±3.0 dyne/cm
    Molar Volume: 163.8±3.0 cm3

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