ChemSpider 2D Image | 3-(1-Propyl-5-sulfamoyl-1H-benzimidazol-2-yl)propanoate | C13H16N3O4S

3-(1-Propyl-5-sulfamoyl-1H-benzimidazol-2-yl)propanoate

  • Molecular FormulaC13H16N3O4S
  • Average mass310.349 Da
  • Monoisotopic mass310.086700 Da
  • ChemSpider ID21214340

  • Charge - Charge

More details:

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

1H-Benzimidazole-2-propanoic acid, 5-(aminosulfonyl)-1-propyl-, ion(1-) [ACD/Index Name]
3-(1-Propyl-5-sulfamoyl-1H-benzimidazol-2-yl)propanoat [German] [ACD/IUPAC Name]
3-(1-Propyl-5-sulfamoyl-1H-benzimidazol-2-yl)propanoate [ACD/IUPAC Name]
3-(1-Propyl-5-sulfamoyl-1H-benzimidazol-2-yl)propanoate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 614.2±61.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.8±3.0 kJ/mol
Flash Point: 325.3±33.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.96
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.76
ACD/LogD (pH 7.4): -2.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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