ChemSpider 2D Image | 3-[2-(2-Sulfanylethoxy)ethoxy]propanoic acid | C7H14O4S

3-[2-(2-Sulfanylethoxy)ethoxy]propanoic acid

  • Molecular FormulaC7H14O4S
  • Average mass194.249 Da
  • Monoisotopic mass194.061279 Da
  • ChemSpider ID29354341

More details:

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

3-[2-(2-Sulfanylethoxy)ethoxy]propanoic acid [ACD/IUPAC Name]
3-[2-(2-Sulfanylethoxy)ethoxy]propansäure [German] [ACD/IUPAC Name]
Acide 3-[2-(2-sulfanyléthoxy)éthoxy]propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[2-(2-mercaptoethoxy)ethoxy]- [ACD/Index Name]
1032347-93-5 [RN]
1379649-73-6 [RN]
HS-PEG12-CH2CH2COOH
HS-PEG2-CH2CH2COOH
MFCD24503001
Thiol-PEG2-acid

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 329.0±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 62.8±6.0 kJ/mol
    Flash Point: 152.8±25.1 °C
    Index of Refraction: 1.485
    Molar Refractivity: 47.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 0.06
    ACD/LogD (pH 5.5): -1.01
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.82
    ACD/LogD (pH 7.4): -2.79
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 95 Å2
    Polarizability: 18.8±0.5 10-24cm3
    Surface Tension: 43.0±3.0 dyne/cm
    Molar Volume: 165.5±3.0 cm3

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