ChemSpider 2D Image | 2-Methyl-2-propanyl N-[3-(acetylsulfanyl)-2-methylpropanoyl]glycinate | C12H21NO4S

2-Methyl-2-propanyl N-[3-(acetylsulfanyl)-2-methylpropanoyl]glycinate

  • Molecular FormulaC12H21NO4S
  • Average mass275.364 Da
  • Monoisotopic mass275.119141 Da
  • ChemSpider ID22568544

More details:

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

1076198-75-8 [RN]
2-Methyl-2-propanyl N-[3-(acetylsulfanyl)-2-methylpropanoyl]glycinate [ACD/IUPAC Name]
2-Methyl-2-propanyl-N-[3-(acetylsulfanyl)-2-methylpropanoyl]glycinat [German] [ACD/IUPAC Name]
Glycine, N-[3-(acetylthio)-2-methyl-1-oxopropyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-[3-(Acétylsulfanyl)-2-méthylpropanoyl]glycinate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
N-[3-(Acetylthio)-2-methyl-1-oxopropyl]glycine 1,1-dimethylethyl ester
1190018-72-4 [RN]
148674-34-4 [RN]
932-49-0 [RN]
N-(3-Acetylthio-2-methylpropanoyl)glycine tert-Butyl Ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 400.8±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.2±3.0 kJ/mol
    Flash Point: 196.2±23.2 °C
    Index of Refraction: 1.485
    Molar Refractivity: 71.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 1.32
    ACD/LogD (pH 5.5): 1.43
    ACD/BCF (pH 5.5): 7.24
    ACD/KOC (pH 5.5): 143.56
    ACD/LogD (pH 7.4): 1.43
    ACD/BCF (pH 7.4): 7.24
    ACD/KOC (pH 7.4): 143.56
    Polar Surface Area: 98 Å2
    Polarizability: 28.1±0.5 10-24cm3
    Surface Tension: 38.2±3.0 dyne/cm
    Molar Volume: 247.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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