ChemSpider 2D Image | 5-Chloro-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-benzothiophene-2-sulfonamide | C12H10ClN3O3S2

5-Chloro-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-benzothiophene-2-sulfonamide

  • Molecular FormulaC12H10ClN3O3S2
  • Average mass343.809 Da
  • Monoisotopic mass342.985199 Da
  • ChemSpider ID30447251

More details:

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

5-Chlor-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-benzothiophen-2-sulfonamid [German] [ACD/IUPAC Name]
5-Chloro-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-1-benzothiophene-2-sulfonamide [ACD/IUPAC Name]
5-Chloro-N-[(5-méthyl-1,2,4-oxadiazol-3-yl)méthyl]-1-benzothiophène-2-sulfonamide [French] [ACD/IUPAC Name]
Benzo[b]thiophene-2-sulfonamide, 5-chloro-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]- [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: 562.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 293.7±32.9 °C
Index of Refraction: 1.659
Molar Refractivity: 81.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 64.13
ACD/KOC (pH 5.5): 678.91
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 21.18
ACD/KOC (pH 7.4): 224.21
Polar Surface Area: 122 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 68.0±3.0 dyne/cm
Molar Volume: 221.8±3.0 cm3

Click to predict properties on the Chemicalize site


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