ChemSpider 2D Image | 5-[1-(2,2-Difluoroethyl)-1H-pyrazol-5-yl]-3-(4-methoxy-5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazole | C12H11F2N5O2S

5-[1-(2,2-Difluoroethyl)-1H-pyrazol-5-yl]-3-(4-methoxy-5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazole

  • Molecular FormulaC12H11F2N5O2S
  • Average mass327.310 Da
  • Monoisotopic mass327.060150 Da
  • ChemSpider ID108035257

More details:

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

1,2,4-Oxadiazole, 5-[1-(2,2-difluoroethyl)-1H-pyrazol-5-yl]-3-(4-methoxy-5-methyl-2-thiazolyl)- [ACD/Index Name]
5-[1-(2,2-Difluorethyl)-1H-pyrazol-5-yl]-3-(4-methoxy-5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazol [German] [ACD/IUPAC Name]
5-[1-(2,2-Difluoroethyl)-1H-pyrazol-5-yl]-3-(4-methoxy-5-methyl-1,3-thiazol-2-yl)-1,2,4-oxadiazole [ACD/IUPAC Name]
5-[1-(2,2-Difluoroéthyl)-1H-pyrazol-5-yl]-3-(4-méthoxy-5-méthyl-1,3-thiazol-2-yl)-1,2,4-oxadiazole [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: 498.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 255.0±31.5 °C
Index of Refraction: 1.682
Molar Refractivity: 76.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.98
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 15.57
ACD/KOC (pH 5.5): 248.31
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 15.57
ACD/KOC (pH 7.4): 248.31
Polar Surface Area: 107 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 51.4±7.0 dyne/cm
Molar Volume: 201.5±7.0 cm3

Click to predict properties on the Chemicalize site


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