ChemSpider 2D Image | N-Isopropyl-N-(methylsulfonyl)glycine | C6H13NO4S

N-Isopropyl-N-(methylsulfonyl)glycine

  • Molecular FormulaC6H13NO4S
  • Average mass195.237 Da
  • Monoisotopic mass195.056534 Da
  • ChemSpider ID21379532

More details:

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

Glycine, N-(1-methylethyl)-N-(methylsulfonyl)- [ACD/Index Name]
N-Isopropyl-N-(methylsulfonyl)glycin [German] [ACD/IUPAC Name]
N-Isopropyl-N-(methylsulfonyl)glycine [ACD/IUPAC Name]
N-Isopropyl-N-(méthylsulfonyl)glycine [French] [ACD/IUPAC Name]
(N-ISOPROPYLMETHANESULFONAMIDO)ACETIC ACID
2-(N-isopropylmethylsulfonamido)acetic acid
2-[N-(PROPAN-2-YL)METHANESULFONAMIDO]ACETIC ACID
905587-49-7 [RN]
MFCD09788596

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 335.8±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 63.6±6.0 kJ/mol
    Flash Point: 156.9±28.4 °C
    Index of Refraction: 1.497
    Molar Refractivity: 44.1±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.34
    ACD/LogD (pH 5.5): -1.79
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.29
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 83 Å2
    Polarizability: 17.5±0.5 10-24cm3
    Surface Tension: 48.9±3.0 dyne/cm
    Molar Volume: 150.9±3.0 cm3

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