ChemSpider 2D Image | Methyl 4-[(5-propyl-1,3,4-oxadiazol-2-yl)sulfamoyl]-2-thiophenecarboxylate | C11H13N3O5S2

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

  • Molecular FormulaC11H13N3O5S2
  • Average mass331.368 Da
  • Monoisotopic mass331.029663 Da
  • ChemSpider ID65081452

More details:

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

2-Thiophenecarboxylic 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]-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4-[(5-propyl-1,3,4-oxadiazol-2-yl)sulfamoyl]-2-thiophenecarboxylate [ACD/IUPAC Name]
Methyl-4-[(5-propyl-1,3,4-oxadiazol-2-yl)sulfamoyl]-2-thiophencarboxylat [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: 520.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.5±32.9 °C
Index of Refraction: 1.584
Molar Refractivity: 75.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 5.18
ACD/KOC (pH 5.5): 92.74
ACD/LogD (pH 7.4): -0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.09
Polar Surface Area: 148 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 224.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement