ChemSpider 2D Image | [3-(2-Thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-sulfamoylbenzoate | C14H11N3O5S2

[3-(2-Thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-sulfamoylbenzoate

  • Molecular FormulaC14H11N3O5S2
  • Average mass365.384 Da
  • Monoisotopic mass365.014008 Da
  • ChemSpider ID21739634

More details:

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

[3-(2-Thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-sulfamoylbenzoate [ACD/IUPAC Name]
[3-(2-Thienyl)-1,2,4-oxadiazol-5-yl]methyl-4-sulfamoylbenzoat [German] [ACD/IUPAC Name]
4-Sulfamoylbenzoate de [3-(2-thiényl)-1,2,4-oxadiazol-5-yl]méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(aminosulfonyl)-, [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester [ACD/Index 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: 643.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 342.8±34.3 °C
Index of Refraction: 1.632
Molar Refractivity: 85.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.46
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 16.20
ACD/KOC (pH 5.5): 255.52
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 16.12
ACD/KOC (pH 7.4): 254.17
Polar Surface Area: 162 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 68.8±3.0 dyne/cm
Molar Volume: 241.0±3.0 cm3

Click to predict properties on the Chemicalize site


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