ChemSpider 2D Image | 3-Methyl-1-(2-thienylsulfonyl)-2,5-dihydro-1H-pyrrole-2-carboxylic acid | C10H11NO4S2

3-Methyl-1-(2-thienylsulfonyl)-2,5-dihydro-1H-pyrrole-2-carboxylic acid

  • Molecular FormulaC10H11NO4S2
  • Average mass273.329 Da
  • Monoisotopic mass273.012939 Da
  • ChemSpider ID25497623

More details:

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

1H-Pyrrole-2-carboxylic acid, 2,5-dihydro-3-methyl-1-(2-thienylsulfonyl)- [ACD/Index Name]
3-Methyl-1-(2-thienylsulfonyl)-2,5-dihydro-1H-pyrrol-2-carbonsäure [German] [ACD/IUPAC Name]
3-Methyl-1-(2-thienylsulfonyl)-2,5-dihydro-1H-pyrrole-2-carboxylic acid [ACD/IUPAC Name]
Acide 3-méthyl-1-(2-thiénylsulfonyl)-2,5-dihydro-1H-pyrrole-2-carboxylique [French] [ACD/IUPAC Name]
1218609-65-4 [RN]
3-methyl-1-(thiophen-2-ylsulfonyl)-2,5-dihydro-1H-pyrrole-2-carboxylic acid
3-methyl-1-(thiophene-2-sulfonyl)-2,5-dihydro-1H-pyrrole-2-carboxylic acid
3-methyl-1-thiophen-2-ylsulfonyl-2,5-dihydropyrrole-2-carboxylic acid
AGN-PC-09MP93
AKOS015948675
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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: 480.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.5±3.0 kJ/mol
    Flash Point: 244.6±31.5 °C
    Index of Refraction: 1.637
    Molar Refractivity: 64.6±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.28
    ACD/LogD (pH 5.5): -1.40
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.59
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 111 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 64.1±3.0 dyne/cm
    Molar Volume: 180.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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