ChemSpider 2D Image | N-(2-Hydroxyethyl)-3-(2,3,4-trichlorophenyl)-1H-pyrazole-5-carboxamide | C12H10Cl3N3O2

N-(2-Hydroxyethyl)-3-(2,3,4-trichlorophenyl)-1H-pyrazole-5-carboxamide

  • Molecular FormulaC12H10Cl3N3O2
  • Average mass334.586 Da
  • Monoisotopic mass332.983856 Da
  • ChemSpider ID23344444

More details:

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

1H-Pyrazole-5-carboxamide, N-(2-hydroxyethyl)-3-(2,3,4-trichlorophenyl)- [ACD/Index Name]
N-(2-Hydroxyethyl)-3-(2,3,4-trichlorophenyl)-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
N-(2-Hydroxyéthyl)-3-(2,3,4-trichlorophényl)-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
N-(2-Hydroxyethyl)-3-(2,3,4-trichlorphenyl)-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
CHEMBL461194
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL461194/

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

Density: 1.5±0.1 g/cm3
Boiling Point: 603.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.3±3.0 kJ/mol
Flash Point: 318.5±31.5 °C
Index of Refraction: 1.638
Molar Refractivity: 77.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.16
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.26
Polar Surface Area: 78 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 216.5±3.0 cm3

Click to predict properties on the Chemicalize site


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