ChemSpider 2D Image | Methyl 4-[(5-propyl-1,3,4-oxadiazol-2-yl)sulfamoyl]-1H-pyrrole-2-carboxylate | C11H14N4O5S

Methyl 4-[(5-propyl-1,3,4-oxadiazol-2-yl)sulfamoyl]-1H-pyrrole-2-carboxylate

  • Molecular FormulaC11H14N4O5S
  • Average mass314.318 Da
  • Monoisotopic mass314.068481 Da
  • ChemSpider ID65107146

More details:

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

1H-Pyrrole-2-carboxylic acid, 4-[[(5-propyl-1,3,4-oxadiazol-2-yl)amino]sulfonyl]-, methyl ester [ACD/Index Name]
4-[(5-Propyl-1,3,4-oxadiazol-2-yl)sulfamoyl]-1H-pyrrole-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4-[(5-propyl-1,3,4-oxadiazol-2-yl)sulfamoyl]-1H-pyrrole-2-carboxylate [ACD/IUPAC Name]
Methyl-4-[(5-propyl-1,3,4-oxadiazol-2-yl)sulfamoyl]-1H-pyrrol-2-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 547.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 284.7±32.9 °C
Index of Refraction: 1.579
Molar Refractivity: 70.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 2.41
ACD/KOC (pH 5.5): 63.49
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.80
Polar Surface Area: 136 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 69.2±3.0 dyne/cm
Molar Volume: 213.3±3.0 cm3

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