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Search term: YLVHPVKPVUCOMX (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2,5-Dimethoxybenzyl 4-methoxybenzenesulfonate | C16H18O6S

2,5-Dimethoxybenzyl 4-methoxybenzenesulfonate

  • Molecular FormulaC16H18O6S
  • Average mass338.375 Da
  • Monoisotopic mass338.082397 Da
  • ChemSpider ID28555843

More details:

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

2,5-Dimethoxybenzyl 4-methoxybenzenesulfonate [ACD/IUPAC Name]
2,5-Dimethoxybenzyl-4-methoxybenzolsulfonat [German] [ACD/IUPAC Name]
4-Méthoxybenzènesulfonate de 2,5-diméthoxybenzyle [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 4-methoxy-, (2,5-dimethoxyphenyl)methyl ester [ACD/Index Name]
(2,5-Dimethoxyphenyl)methyl 4-methoxybenzene-1-sulfonate
194535-88-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 490.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.9±3.0 kJ/mol
Flash Point: 250.7±28.7 °C
Index of Refraction: 1.547
Molar Refractivity: 85.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 84.85
ACD/KOC (pH 5.5): 835.88
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 84.85
ACD/KOC (pH 7.4): 835.88
Polar Surface Area: 79 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 270.3±3.0 cm3

Click to predict properties on the Chemicalize site


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