Found 3016 results

Search term: MF = 'C_{11}H_{12}N_{2}O_{4}S'
ChemSpider 2D Image | 3-[(1H-Benzimidazol-2-ylmethyl)sulfonyl]propanoic acid | C11H12N2O4S

3-[(1H-Benzimidazol-2-ylmethyl)sulfonyl]propanoic acid

  • Molecular FormulaC11H12N2O4S
  • Average mass268.289 Da
  • Monoisotopic mass268.051788 Da
  • ChemSpider ID21786154

More details:

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

1092291-31-0 [RN]
3-[(1H-1,3-benzodiazol-2-yl)methanesulfonyl]propanoic acid
3-[(1H-Benzimidazol-2-ylmethyl)sulfonyl]propanoic acid [ACD/IUPAC Name]
3-[(1H-Benzimidazol-2-ylmethyl)sulfonyl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[(1H-benzimidazol-2-ylméthyl)sulfonyl]propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[(1H-benzimidazol-2-ylmethyl)sulfonyl]- [ACD/Index Name]
3-(((1H-Benzo[d]imidazol-2-yl)methyl)sulfonyl)propanoic acid
3-(1H-1,3-benzodiazol-2-ylmethanesulfonyl)propanoic acid
3-(1H-benzimidazol-2-ylmethylsulfonyl)propanoic acid
3-[(1H-Benzimidazol-2-ylmethyl)sulfonyl]-propanoic acid
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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: 679.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 104.7±3.0 kJ/mol
    Flash Point: 364.4±27.3 °C
    Index of Refraction: 1.658
    Molar Refractivity: 65.0±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.81
    ACD/LogD (pH 5.5): -1.49
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.09
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 109 Å2
    Polarizability: 25.8±0.5 10-24cm3
    Surface Tension: 78.7±3.0 dyne/cm
    Molar Volume: 176.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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