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Search term: BGBUTEUEYFVVOU (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-{[3-(2-Chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl}-N-ethyl-2-methoxyethanamine | C21H23ClFN3O

N-{[3-(2-Chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl}-N-ethyl-2-methoxyethanamine

  • Molecular FormulaC21H23ClFN3O
  • Average mass387.878 Da
  • Monoisotopic mass387.151367 Da
  • ChemSpider ID29736318

More details:

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

1H-Pyrazole-4-methanamine, 3-(2-chlorophenyl)-N-ethyl-1-(4-fluorophenyl)-N-(2-methoxyethyl)- [ACD/Index Name]
N-{[3-(2-Chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazol-4-yl]methyl}-N-ethyl-2-methoxyethanamine [ACD/IUPAC Name]
N-{[3-(2-Chlorophényl)-1-(4-fluorophényl)-1H-pyrazol-4-yl]méthyl}-N-éthyl-2-méthoxyéthanamine [French] [ACD/IUPAC Name]
N-{[3-(2-Chlorphenyl)-1-(4-fluorphenyl)-1H-pyrazol-4-yl]methyl}-N-ethyl-2-methoxyethanamin [German] [ACD/IUPAC Name]
{[3-(2-CHLOROPHENYL)-1-(4-FLUOROPHENYL)-1H-PYRAZOL-4-YL]METHYL}(ETHYL)(2-METHOXYETHYL)AMINE
{[3-(2-CHLOROPHENYL)-1-(4-FLUOROPHENYL)PYRAZOL-4-YL]METHYL}(ETHYL)(2-METHOXYETHYL)AMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 484.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 247.0±28.7 °C
Index of Refraction: 1.573
Molar Refractivity: 108.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 3.49
ACD/BCF (pH 5.5): 102.64
ACD/KOC (pH 5.5): 314.74
ACD/LogD (pH 7.4): 4.97
ACD/BCF (pH 7.4): 3134.07
ACD/KOC (pH 7.4): 9609.91
Polar Surface Area: 30 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 39.3±7.0 dyne/cm
Molar Volume: 328.3±7.0 cm3

Click to predict properties on the Chemicalize site


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