ChemSpider 2D Image | (2E)-3-(2-{[(2,2,2-Trifluoroethyl)sulfamoyl]amino}-1,3-thiazol-5-yl)acrylic acid | C8H8F3N3O4S2

(2E)-3-(2-{[(2,2,2-Trifluoroethyl)sulfamoyl]amino}-1,3-thiazol-5-yl)acrylic acid

  • Molecular FormulaC8H8F3N3O4S2
  • Average mass331.292 Da
  • Monoisotopic mass330.990845 Da
  • ChemSpider ID71897260
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-3-(2-{[(2,2,2-Trifluorethyl)sulfamoyl]amino}-1,3-thiazol-5-yl)acrylsäure [German] [ACD/IUPAC Name]
(2E)-3-(2-{[(2,2,2-Trifluoroethyl)sulfamoyl]amino}-1,3-thiazol-5-yl)acrylic acid [ACD/IUPAC Name]
2-Propenoic acid, 3-[2-[[[(2,2,2-trifluoroethyl)amino]sulfonyl]amino]-5-thiazolyl]-, (2E)- [ACD/Index Name]
Acide (2E)-3-(2-{[(2,2,2-trifluoroéthyl)sulfamoyl]amino}-1,3-thiazol-5-yl)acrylique [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 470.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.2±3.0 kJ/mol
Flash Point: 238.1±31.5 °C
Index of Refraction: 1.588
Molar Refractivity: 63.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.29
ACD/LogD (pH 5.5): -1.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 66.7±3.0 dyne/cm
Molar Volume: 189.9±3.0 cm3

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