ChemSpider 2D Image | 3-(2,4-Dichlorophenyl)-N-(1-hydroxy-3-methyl-2-butanyl)-1H-pyrazole-4-carboxamide | C15H17Cl2N3O2

3-(2,4-Dichlorophenyl)-N-(1-hydroxy-3-methyl-2-butanyl)-1H-pyrazole-4-carboxamide

  • Molecular FormulaC15H17Cl2N3O2
  • Average mass342.220 Da
  • Monoisotopic mass341.069794 Da
  • ChemSpider ID32515280
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1H-Pyrazole-4-carboxamide, 3-(2,4-dichlorophenyl)-N-[1-(hydroxymethyl)-2-methylpropyl]- [ACD/Index Name]
3-(2,4-Dichlorophenyl)-N-(1-hydroxy-3-methyl-2-butanyl)-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
3-(2,4-Dichlorophényl)-N-(1-hydroxy-3-méthyl-2-butanyl)-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
3-(2,4-Dichlorphenyl)-N-(1-hydroxy-3-methyl-2-butanyl)-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
1630934-63-2 [RN]
5-(2,4-dichlorophenyl)-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-1H-pyrazole-4-carboxamide
C15H17Cl2N3O2

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

Density: 1.3±0.1 g/cm3
Boiling Point: 573.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 300.4±30.1 °C
Index of Refraction: 1.597
Molar Refractivity: 86.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 106.98
ACD/KOC (pH 5.5): 986.70
ACD/LogD (pH 7.4): 2.97
ACD/BCF (pH 7.4): 106.75
ACD/KOC (pH 7.4): 984.60
Polar Surface Area: 78 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 254.8±3.0 cm3

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