ChemSpider 2D Image | (1R)-1-(2,3-Dichlorophenyl)ethanamine | C8H9Cl2N

(1R)-1-(2,3-Dichlorophenyl)ethanamine

  • Molecular FormulaC8H9Cl2N
  • Average mass190.070 Da
  • Monoisotopic mass189.011200 Da
  • ChemSpider ID50093218

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-1-(2,3-Dichlorophenyl)ethanamine [ACD/IUPAC Name]
(1R)-1-(2,3-Dichlorophényl)éthanamine [French] [ACD/IUPAC Name]
(1R)-1-(2,3-Dichlorphenyl)ethanamin [German] [ACD/IUPAC Name]
Benzenemethanamine, 2,3-dichloro-α-methyl-, (αR)- [ACD/Index Name]
(1R)-1-(2,3-dichlorophenyl)ethan-1-amine
(1r)-1-(2,3-dichlorophenyl)ethylamine
(R)-1-(2,3-dichlorophenyl)ethanamine
1415303-40-0 [RN]
MFCD06762081 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 248.9±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 48.6±3.0 kJ/mol
    Flash Point: 104.3±23.2 °C
    Index of Refraction: 1.566
    Molar Refractivity: 49.1±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.50
    ACD/LogD (pH 5.5): -0.13
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.39
    ACD/LogD (pH 7.4): 1.56
    ACD/BCF (pH 7.4): 5.65
    ACD/KOC (pH 7.4): 68.83
    Polar Surface Area: 26 Å2
    Polarizability: 19.5±0.5 10-24cm3
    Surface Tension: 42.0±3.0 dyne/cm
    Molar Volume: 150.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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