ChemSpider 2D Image | Methyl 2,5-dimethyl-4-{propyl[3-(trifluoromethyl)-1H-pyrazol-5-yl]sulfamoyl}-3-furoate | C15H18F3N3O5S

Methyl 2,5-dimethyl-4-{propyl[3-(trifluoromethyl)-1H-pyrazol-5-yl]sulfamoyl}-3-furoate

  • Molecular FormulaC15H18F3N3O5S
  • Average mass409.381 Da
  • Monoisotopic mass409.091919 Da
  • ChemSpider ID65119492

More details:

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

2,5-Diméthyl-4-{propyl[3-(trifluorométhyl)-1H-pyrazol-5-yl]sulfamoyl}-3-furoate de méthyle [French] [ACD/IUPAC Name]
3-Furancarboxylic acid, 2,5-dimethyl-4-[[propyl[3-(trifluoromethyl)-1H-pyrazol-5-yl]amino]sulfonyl]-, methyl ester [ACD/Index Name]
Methyl 2,5-dimethyl-4-{propyl[3-(trifluoromethyl)-1H-pyrazol-5-yl]sulfamoyl}-3-furoate [ACD/IUPAC Name]
Methyl-2,5-dimethyl-4-{propyl[3-(trifluormethyl)-1H-pyrazol-5-yl]sulfamoyl}-3-furoat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 545.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.4±32.9 °C
Index of Refraction: 1.520
Molar Refractivity: 87.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.93
ACD/LogD (pH 5.5): 2.51
ACD/BCF (pH 5.5): 47.22
ACD/KOC (pH 5.5): 547.25
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 22.59
ACD/KOC (pH 7.4): 261.78
Polar Surface Area: 114 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 288.4±3.0 cm3

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