ChemSpider 2D Image | 3-{[(5-Chloro-2-thienyl)sulfonyl]amino}-3-(4-methoxyphenyl)propanoic acid | C14H14ClNO5S2

3-{[(5-Chloro-2-thienyl)sulfonyl]amino}-3-(4-methoxyphenyl)propanoic acid

  • Molecular FormulaC14H14ClNO5S2
  • Average mass375.848 Da
  • Monoisotopic mass375.000183 Da
  • ChemSpider ID23081247

More details:

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

3-{[(5-Chlor-2-thienyl)sulfonyl]amino}-3-(4-methoxyphenyl)propansäure [German] [ACD/IUPAC Name]
3-{[(5-Chloro-2-thienyl)sulfonyl]amino}-3-(4-methoxyphenyl)propanoic acid [ACD/IUPAC Name]
3-{[(5-chlorothiophen-2-yl)sulfonyl]amino}-3-(4-methoxyphenyl)propanoic acid
Acide 3-{[(5-chloro-2-thiényl)sulfonyl]amino}-3-(4-méthoxyphényl)propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-[[(5-chloro-2-thienyl)sulfonyl]amino]-4-methoxy- [ACD/Index Name]
3-(5-CHLOROTHIOPHENE-2-SULFONAMIDO)-3-(4-METHOXYPHENYL)PROPANOIC ACID
3-[(5-chlorothiophen-2-yl)sulfonylamino]-3-(4-methoxyphenyl)propanoic acid
3-{[(5-chloro(2-thienyl))sulfonyl]amino}-3-(4-methoxyphenyl)propanoic acid
909245-87-0 [RN]
MFCD08582956

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 576.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 90.8±3.0 kJ/mol
    Flash Point: 302.3±32.9 °C
    Index of Refraction: 1.615
    Molar Refractivity: 88.8±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.10
    ACD/LogD (pH 5.5): 1.22
    ACD/BCF (pH 5.5): 2.10
    ACD/KOC (pH 5.5): 21.53
    ACD/LogD (pH 7.4): -0.50
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 129 Å2
    Polarizability: 35.2±0.5 10-24cm3
    Surface Tension: 59.3±3.0 dyne/cm
    Molar Volume: 254.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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