Found 2373 results

Search term: MF = 'C_{13}H_{16}ClNO_{3}S'
ChemSpider 2D Image | 2-({2-[(4-Methylphenyl)amino]-2-oxoethyl}sulfanyl)ethyl chloroacetate | C13H16ClNO3S

2-({2-[(4-Methylphenyl)amino]-2-oxoethyl}sulfanyl)ethyl chloroacetate

  • Molecular FormulaC13H16ClNO3S
  • Average mass301.789 Da
  • Monoisotopic mass301.053955 Da
  • ChemSpider ID59703219

More details:

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

2-({2-[(4-Methylphenyl)amino]-2-oxoethyl}sulfanyl)ethyl chloroacetate [ACD/IUPAC Name]
2-({2-[(4-Methylphenyl)amino]-2-oxoethyl}sulfanyl)ethyl-chloracetat [German] [ACD/IUPAC Name]
Acetic acid, 2-chloro-, 2-[[2-[(4-methylphenyl)amino]-2-oxoethyl]thio]ethyl ester [ACD/Index Name]
Chloroacétate de 2-({2-[(4-méthylphényl)amino]-2-oxoéthyl}sulfanyl)éthyle [French] [ACD/IUPAC Name]
2-((2-[(4-MEthylphenyl)amino]-2-oxoethyl)thio)ethyl chloroacetate
2-({2-[(4-methylphenyl)amino]-2-oxoethyl}thio)ethyl chloroacetate
2173090-61-2 [RN]
MFCD31381801

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 488.1±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.4±3.0 kJ/mol
    Flash Point: 249.0±27.3 °C
    Index of Refraction: 1.587
    Molar Refractivity: 78.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 2.88
    ACD/LogD (pH 5.5): 2.61
    ACD/BCF (pH 5.5): 56.62
    ACD/KOC (pH 5.5): 625.73
    ACD/LogD (pH 7.4): 2.61
    ACD/BCF (pH 7.4): 56.62
    ACD/KOC (pH 7.4): 625.75
    Polar Surface Area: 81 Å2
    Polarizability: 31.1±0.5 10-24cm3
    Surface Tension: 50.1±3.0 dyne/cm
    Molar Volume: 233.7±3.0 cm3

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