ChemSpider 2D Image | 5-Amino-4-chloro-2-methylphenyl ethyl carbonate | C10H12ClNO3

5-Amino-4-chloro-2-methylphenyl ethyl carbonate

  • Molecular FormulaC10H12ClNO3
  • Average mass229.660 Da
  • Monoisotopic mass229.050568 Da
  • ChemSpider ID24599523

More details:

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

5-Amino-4-chloro-2-methylphenyl ethyl carbonate [ACD/IUPAC Name]
930298-25-2 [RN]
5-amino-4-chloro-2-methylphenylethylcarbonate
Carbonic acid, 5-amino-4-chloro-2-methylphenyl ethyl ester [ACD/Index Name]
MFCD11878030

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

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 350.1±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.5±3.0 kJ/mol
    Flash Point: 165.6±27.9 °C
    Index of Refraction: 1.555
    Molar Refractivity: 57.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.39
    ACD/LogD (pH 5.5): 2.20
    ACD/BCF (pH 5.5): 27.45
    ACD/KOC (pH 5.5): 372.65
    ACD/LogD (pH 7.4): 2.20
    ACD/BCF (pH 7.4): 27.46
    ACD/KOC (pH 7.4): 372.79
    Polar Surface Area: 62 Å2
    Polarizability: 23.0±0.5 10-24cm3
    Surface Tension: 45.1±3.0 dyne/cm
    Molar Volume: 180.4±3.0 cm3

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