ChemSpider 2D Image | 5-[(1,1-Dioxidotetrahydro-3-thiophenyl)(methyl)carbamoyl]-2-thiophenecarboxylic acid | C11H13NO5S2

5-[(1,1-Dioxidotetrahydro-3-thiophenyl)(methyl)carbamoyl]-2-thiophenecarboxylic acid

  • Molecular FormulaC11H13NO5S2
  • Average mass303.355 Da
  • Monoisotopic mass303.023499 Da
  • ChemSpider ID34145047

More details:

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

2-Thiophenecarboxylic acid, 5-[[methyl(tetrahydro-1,1-dioxido-3-thienyl)amino]carbonyl]- [ACD/Index Name]
5-[(1,1-Dioxidotetrahydro-3-thiophenyl)(methyl)carbamoyl]-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
5-[(1,1-Dioxidotetrahydro-3-thiophenyl)(methyl)carbamoyl]-2-thiophenecarboxylic acid [ACD/IUPAC Name]
Acide 5-[(1,1-dioxydotétrahydro-3-thiophényl)(méthyl)carbamoyl]-2-thiophènecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 647.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.4±3.0 kJ/mol
Flash Point: 345.6±31.5 °C
Index of Refraction: 1.637
Molar Refractivity: 69.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.41
ACD/LogD (pH 5.5): -1.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 73.6±5.0 dyne/cm
Molar Volume: 194.3±5.0 cm3

Click to predict properties on the Chemicalize site


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