ChemSpider 2D Image | 2-[2-(Decyloxy)ethoxy]ethyl 4-methylbenzenesulfonate | C21H36O5S

2-[2-(Decyloxy)ethoxy]ethyl 4-methylbenzenesulfonate

  • Molecular FormulaC21H36O5S
  • Average mass400.573 Da
  • Monoisotopic mass400.228333 Da
  • ChemSpider ID128938378

More details:

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

2-[2-(Decyloxy)ethoxy]ethyl 4-methylbenzenesulfonate [ACD/IUPAC Name]
2-[2-(Decyloxy)ethoxy]ethyl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
4-Méthylbenzènesulfonate de 2-[2-(décyloxy)éthoxy]éthyle [French] [ACD/IUPAC Name]
Ethanol, 2-[2-(decyloxy)ethoxy]-, 4-methylbenzenesulfonate [ACD/Index Name]
102421-56-7 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 504.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 258.7±25.9 °C
Index of Refraction: 1.490
Molar Refractivity: 110.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 5.73
ACD/LogD (pH 5.5): 6.36
ACD/BCF (pH 5.5): 39816.91
ACD/KOC (pH 5.5): 68282.83
ACD/LogD (pH 7.4): 6.36
ACD/BCF (pH 7.4): 39816.91
ACD/KOC (pH 7.4): 68282.83
Polar Surface Area: 70 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 381.2±3.0 cm3

Click to predict properties on the Chemicalize site


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