ChemSpider 2D Image | 5-Isobutoxy-3-methoxy-2-thiophenecarboxylic acid | C10H14O4S

5-Isobutoxy-3-methoxy-2-thiophenecarboxylic acid

  • Molecular FormulaC10H14O4S
  • Average mass230.281 Da
  • Monoisotopic mass230.061279 Da
  • ChemSpider ID35492241

More details:

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

2-Thiophenecarboxylic acid, 3-methoxy-5-(2-methylpropoxy)- [ACD/Index Name]
5-Isobutoxy-3-methoxy-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
5-Isobutoxy-3-methoxy-2-thiophenecarboxylic acid [ACD/IUPAC Name]
Acide 5-isobutoxy-3-méthoxy-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
1774902-17-8 [RN]
3-methoxy-5-(2-methylpropoxy)thiophene-2-carboxylic acid
5-Isobutoxy-3-methoxythiophene-2-carboxylic acid
5-Isobutoxy-3-methoxy-thiophene-2-carboxylic acid
MFCD26129446

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 365.1±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.5±3.0 kJ/mol
    Flash Point: 174.6±26.5 °C
    Index of Refraction: 1.533
    Molar Refractivity: 58.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.91
    ACD/LogD (pH 5.5): 1.26
    ACD/BCF (pH 5.5): 2.39
    ACD/KOC (pH 5.5): 24.96
    ACD/LogD (pH 7.4): -0.22
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 84 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 42.2±3.0 dyne/cm
    Molar Volume: 189.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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