ChemSpider 2D Image | (1S)-1-(3,5-Dibromophenyl)ethanamine | C8H9Br2N

(1S)-1-(3,5-Dibromophenyl)ethanamine

  • Molecular FormulaC8H9Br2N
  • Average mass278.972 Da
  • Monoisotopic mass276.910156 Da
  • ChemSpider ID25950253

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-1-(3,5-Dibromophenyl)ethanamine [ACD/IUPAC Name]
(1S)-1-(3,5-Dibromophényl)éthanamine [French] [ACD/IUPAC Name]
(1S)-1-(3,5-Dibromphenyl)ethanamin [German] [ACD/IUPAC Name]
911426-09-0 [RN]
Benzenemethanamine, 3,5-dibromo-α-methyl-, (αS)- [ACD/Index Name]
(aS)-3,5-Dibromo-a-methyl-benzenemethanamine
(S)-1-(3,5-dibromophenyl)ethanamine
(α S)-3,5-DIBROMO-α-METHYL-BENZENEMETHANAMINE
1-(6-(Cyclopropylamino)pyrimidin-4-yl)piperidine-3-carboxylic acid
BenzeneMethanaMine, 3,5-dibroMo-?-Methyl-, (?S)-
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.8±0.1 g/cm3
    Boiling Point: 305.1±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.5±3.0 kJ/mol
    Flash Point: 138.3±23.7 °C
    Index of Refraction: 1.604
    Molar Refractivity: 54.7±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.93
    ACD/LogD (pH 5.5): -0.15
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.15
    ACD/LogD (pH 7.4): 1.49
    ACD/BCF (pH 7.4): 4.46
    ACD/KOC (pH 7.4): 50.80
    Polar Surface Area: 26 Å2
    Polarizability: 21.7±0.5 10-24cm3
    Surface Tension: 45.3±3.0 dyne/cm
    Molar Volume: 159.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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