ChemSpider 2D Image | Dimethyl 5-[(1-ethoxy-3-hydroxy-1-oxo-2-propanyl)sulfamoyl]isophthalate | C15H19NO9S

Dimethyl 5-[(1-ethoxy-3-hydroxy-1-oxo-2-propanyl)sulfamoyl]isophthalate

  • Molecular FormulaC15H19NO9S
  • Average mass389.378 Da
  • Monoisotopic mass389.078064 Da
  • ChemSpider ID30431911

More details:

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

1,3-Benzenedicarboxylic acid, 5-[[[2-ethoxy-1-(hydroxymethyl)-2-oxoethyl]amino]sulfonyl]-, dimethyl ester [ACD/Index Name]
5-[(1-Éthoxy-3-hydroxy-1-oxo-2-propanyl)sulfamoyl]isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-[(1-ethoxy-3-hydroxy-1-oxo-2-propanyl)sulfamoyl]isophthalate [ACD/IUPAC Name]
Dimethyl-5-[(1-ethoxy-3-hydroxy-1-oxo-2-propanyl)sulfamoyl]isophthalat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 566.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 296.4±32.9 °C
Index of Refraction: 1.534
Molar Refractivity: 88.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 1.14
ACD/BCF (pH 5.5): 4.30
ACD/KOC (pH 5.5): 98.44
ACD/LogD (pH 7.4): 0.76
ACD/BCF (pH 7.4): 1.80
ACD/KOC (pH 7.4): 41.18
Polar Surface Area: 154 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 51.9±3.0 dyne/cm
Molar Volume: 283.2±3.0 cm3

Click to predict properties on the Chemicalize site


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