ChemSpider 2D Image | PEG8-Ts | C23H40O11S

PEG8-Ts

  • Molecular FormulaC23H40O11S
  • Average mass524.622 Da
  • Monoisotopic mass524.229126 Da
  • ChemSpider ID29354326

More details:

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

23-Hydroxy-3,6,9,12,15,18,21-heptaoxatricos-1-yl 4-methylbenzenesulfonate [ACD/IUPAC Name]
23-Hydroxy-3,6,9,12,15,18,21-heptaoxatricos-1-yl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
3,6,9,12,15,18,21-Heptaoxatricosane-1,23-diol, mono(4-methylbenzenesulfonate) [ACD/Index Name]
4-Méthylbenzènesulfonate de 23-hydroxy-3,6,9,12,15,18,21-heptaoxatricos-1-yle [French] [ACD/IUPAC Name]
PEG8-OTs
PEG8-Ts
886469-23-4 [RN]
2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate
23-[(4-methylbenzenesulfonyl)oxy]-3,6,9,12,15,18,21-heptaoxatricosan-1-ol
MFCD26127806
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 615.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.9±3.0 kJ/mol
    Flash Point: 325.8±31.5 °C
    Index of Refraction: 1.497
    Molar Refractivity: 129.8±0.4 cm3
    #H bond acceptors: 11
    #H bond donors: 1
    #Freely Rotating Bonds: 25
    #Rule of 5 Violations: 2
    ACD/LogP: -1.56
    ACD/LogD (pH 5.5): 0.04
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 25.08
    ACD/LogD (pH 7.4): 0.04
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 25.08
    Polar Surface Area: 137 Å2
    Polarizability: 51.4±0.5 10-24cm3
    Surface Tension: 44.0±3.0 dyne/cm
    Molar Volume: 443.5±3.0 cm3

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