ChemSpider 2D Image | 2-[2-(2-Propyn-1-yloxy)ethoxy]ethyl 4-methylbenzenesulfonate | C14H18O5S

2-[2-(2-Propyn-1-yloxy)ethoxy]ethyl 4-methylbenzenesulfonate

  • Molecular FormulaC14H18O5S
  • Average mass298.355 Da
  • Monoisotopic mass298.087494 Da
  • ChemSpider ID25933169

More details:

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

2-[2-(2-Propin-1-yloxy)ethoxy]ethyl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
2-[2-(2-Propyn-1-yloxy)ethoxy]ethyl 4-methylbenzenesulfonate [ACD/IUPAC Name]
4-Méthylbenzènesulfonate de 2-[2-(2-propyn-1-yloxy)éthoxy]éthyle [French] [ACD/IUPAC Name]
Ethanol, 2-[2-(2-propyn-1-yloxy)ethoxy]-, 4-methylbenzenesulfonate [ACD/Index Name]
1119249-30-7 [RN]
2-(2-(Prop-2-ynyloxy)ethoxy)ethyl 4-methylbenzenesulfonate
2-(2-prop-2-ynoxyethoxy)ethyl 4-methylbenzenesulfonate
2-[2-(prop-2-yn-1-yloxy)ethoxy]ethyl 4-methylbenzene-1-sulfonate
2-[2-(prop-2-yn-1-yloxy)ethoxy]ethyl 4-methylbenzenesulfonate
MFCD20134051
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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: 428.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 65.7±3.0 kJ/mol
    Flash Point: 212.8±25.9 °C
    Index of Refraction: 1.519
    Molar Refractivity: 75.6±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 0
    ACD/LogP: 1.50
    ACD/LogD (pH 5.5): 2.13
    ACD/BCF (pH 5.5): 24.52
    ACD/KOC (pH 5.5): 343.78
    ACD/LogD (pH 7.4): 2.13
    ACD/BCF (pH 7.4): 24.52
    ACD/KOC (pH 7.4): 343.78
    Polar Surface Area: 70 Å2
    Polarizability: 30.0±0.5 10-24cm3
    Surface Tension: 44.1±3.0 dyne/cm
    Molar Volume: 249.4±3.0 cm3

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