ChemSpider 2D Image | 2-Ethoxyphenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate | C16H16O6S

2-Ethoxyphenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate

  • Molecular FormulaC16H16O6S
  • Average mass336.360 Da
  • Monoisotopic mass336.066772 Da
  • ChemSpider ID22767052

More details:

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

1,4-Benzodioxin-6-sulfonic acid, 2,3-dihydro-, 2-ethoxyphenyl ester [ACD/Index Name]
2,3-Dihydro-1,4-benzodioxine-6-sulfonate de 2-éthoxyphényle [French] [ACD/IUPAC Name]
2-Ethoxyphenyl 2,3-dihydro-1,4-benzodioxine-6-sulfonate [ACD/IUPAC Name]
2-Ethoxyphenyl-2,3-dihydro-1,4-benzodioxin-6-sulfonat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 498.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 255.3±28.7 °C
Index of Refraction: 1.577
Molar Refractivity: 83.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.86
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 127.95
ACD/KOC (pH 5.5): 1121.56
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 127.95
ACD/KOC (pH 7.4): 1121.56
Polar Surface Area: 79 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 252.5±3.0 cm3

Click to predict properties on the Chemicalize site


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