ChemSpider 2D Image | 3,5-Dimethylphenyl 2-(dimethylsulfamoyl)ethanesulfonate | C12H19NO5S2

3,5-Dimethylphenyl 2-(dimethylsulfamoyl)ethanesulfonate

  • Molecular FormulaC12H19NO5S2
  • Average mass321.413 Da
  • Monoisotopic mass321.070465 Da
  • ChemSpider ID65134888

More details:

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

2-(Diméthylsulfamoyl)éthanesulfonate de 3,5-diméthylphényle [French] [ACD/IUPAC Name]
3,5-Dimethylphenyl 2-(dimethylsulfamoyl)ethanesulfonate [ACD/IUPAC Name]
3,5-Dimethylphenyl-2-(dimethylsulfamoyl)ethansulfonat [German] [ACD/IUPAC Name]
Ethanesulfonic acid, 2-[(dimethylamino)sulfonyl]-, 3,5-dimethylphenyl ester [ACD/Index 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: 485.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 247.4±31.5 °C
Index of Refraction: 1.548
Molar Refractivity: 77.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.09
ACD/LogD (pH 5.5): 1.68
ACD/BCF (pH 5.5): 11.13
ACD/KOC (pH 5.5): 195.28
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.13
ACD/KOC (pH 7.4): 195.28
Polar Surface Area: 98 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 244.8±3.0 cm3

Click to predict properties on the Chemicalize site


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