ChemSpider 2D Image | 3-{2-[2-(2-Sulfanylethoxy)ethoxy]ethoxy}propanoic acid | C9H18O5S

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

  • Molecular FormulaC9H18O5S
  • Average mass238.301 Da
  • Monoisotopic mass238.087494 Da
  • ChemSpider ID29354342

More details:

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

3-{2-[2-(2-Sulfanylethoxy)ethoxy]ethoxy}propanoic acid [ACD/IUPAC Name]
3-{2-[2-(2-Sulfanylethoxy)ethoxy]ethoxy}propansäure [German] [ACD/IUPAC Name]
Acide 3-{2-[2-(2-sulfanyléthoxy)éthoxy]éthoxy}propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[2-[2-(2-mercaptoethoxy)ethoxy]ethoxy]- [ACD/Index Name]
1347750-82-6 [RN]
3-(2-(2-(2-mercaptoethoxy)ethoxy)ethoxy)propanoic acid
HS-PEG3-CH2CH2COOH
MFCD25424073
Thiol-PEG3-acid
Thiol-PEG4-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: 377.5±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 68.7±6.0 kJ/mol
    Flash Point: 182.1±26.5 °C
    Index of Refraction: 1.482
    Molar Refractivity: 58.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 0
    ACD/LogP: -0.30
    ACD/LogD (pH 5.5): -1.20
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.42
    ACD/LogD (pH 7.4): -2.99
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 104 Å2
    Polarizability: 23.2±0.5 10-24cm3
    Surface Tension: 42.4±3.0 dyne/cm
    Molar Volume: 204.9±3.0 cm3

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