ChemSpider 2D Image | 4-(2-Methyl-2-propanyl)phenyl 3,4-dimethoxybenzenesulfonate | C18H22O5S

4-(2-Methyl-2-propanyl)phenyl 3,4-dimethoxybenzenesulfonate

  • Molecular FormulaC18H22O5S
  • Average mass350.429 Da
  • Monoisotopic mass350.118805 Da
  • ChemSpider ID21674114

More details:

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

3,4-Diméthoxybenzènesulfonate de 4-(2-méthyl-2-propanyl)phényle [French] [ACD/IUPAC Name]
4-(2-Methyl-2-propanyl)phenyl 3,4-dimethoxybenzenesulfonate [ACD/IUPAC Name]
4-(2-Methyl-2-propanyl)phenyl-3,4-dimethoxybenzolsulfonat [German] [ACD/IUPAC Name]
Benzenesulfonic acid, 3,4-dimethoxy-, 4-(1,1-dimethylethyl)phenyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 469.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.4±3.0 kJ/mol
Flash Point: 237.8±28.7 °C
Index of Refraction: 1.539
Molar Refractivity: 93.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 4.45
ACD/BCF (pH 5.5): 1425.16
ACD/KOC (pH 5.5): 6296.99
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1425.16
ACD/KOC (pH 7.4): 6296.99
Polar Surface Area: 70 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 297.8±3.0 cm3

Click to predict properties on the Chemicalize site


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