ChemSpider 2D Image | 2-[(6-Acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl 5-sulfamoyl-2-furoate | C16H14N2O9S

2-[(6-Acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl 5-sulfamoyl-2-furoate

  • Molecular FormulaC16H14N2O9S
  • Average mass410.355 Da
  • Monoisotopic mass410.041992 Da
  • ChemSpider ID33727851

More details:

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

2-[(6-Acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl 5-sulfamoyl-2-furoate [ACD/IUPAC Name]
2-[(6-Acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl-5-sulfamoyl-2-furoat [German] [ACD/IUPAC Name]
2-Furancarboxylic acid, 5-(aminosulfonyl)-, 2-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-oxoethyl ester [ACD/Index Name]
5-Sulfamoyl-2-furoate de 2-[(6-acétyl-1,3-benzodioxol-5-yl)amino]-2-oxoéthyle [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.622
Molar Refractivity: 91.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 0.30
ACD/LogD (pH 5.5): 0.50
ACD/BCF (pH 5.5): 1.41
ACD/KOC (pH 5.5): 44.46
ACD/LogD (pH 7.4): 0.49
ACD/BCF (pH 7.4): 1.39
ACD/KOC (pH 7.4): 43.99
Polar Surface Area: 173 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 70.3±3.0 dyne/cm
Molar Volume: 259.3±3.0 cm3

Click to predict properties on the Chemicalize site


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