ChemSpider 2D Image | 1-[(Methylsulfonyl)amino]cyclopropanecarboxylic acid | C5H9NO4S

1-[(Methylsulfonyl)amino]cyclopropanecarboxylic acid

  • Molecular FormulaC5H9NO4S
  • Average mass179.194 Da
  • Monoisotopic mass179.025223 Da
  • ChemSpider ID35498404

More details:

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

1-[(Methylsulfonyl)amino]cyclopropancarbonsäure [German] [ACD/IUPAC Name]
1-[(Methylsulfonyl)amino]cyclopropanecarboxylic acid [ACD/IUPAC Name]
Acide 1-[(méthylsulfonyl)amino]cyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 1-[(methylsulfonyl)amino]- [ACD/Index Name]
1-(methanesulfonamido)cyclopropane-1-carboxylic acid
1-(methylsulfonamido)cyclopropanecarboxylic acid
1707667-87-5 [RN]
1-Methanesulfonylamino-cyclopropanecarboxylic acid
AGN-PC-0DLRYU
AKOS009162261
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 369.5±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 67.7±6.0 kJ/mol
    Flash Point: 177.3±28.4 °C
    Index of Refraction: 1.557
    Molar Refractivity: 37.3±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -1.47
    ACD/LogD (pH 5.5): -3.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.37
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 92 Å2
    Polarizability: 14.8±0.5 10-24cm3
    Surface Tension: 63.6±5.0 dyne/cm
    Molar Volume: 115.8±5.0 cm3

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