ChemSpider 2D Image | N-(4-Bromo-2-fluorobenzyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide | C14H15BrFN3O

N-(4-Bromo-2-fluorobenzyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide

  • Molecular FormulaC14H15BrFN3O
  • Average mass340.191 Da
  • Monoisotopic mass339.038239 Da
  • ChemSpider ID28514615

More details:

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

1H-Pyrazole-4-acetamide, N-[(4-bromo-2-fluorophenyl)methyl]-3,5-dimethyl- [ACD/Index Name]
N-(4-Brom-2-fluorbenzyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamid [German] [ACD/IUPAC Name]
N-(4-Bromo-2-fluorobenzyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide [ACD/IUPAC Name]
N-(4-Bromo-2-fluorobenzyl)-2-(3,5-diméthyl-1H-pyrazol-4-yl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 582.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 306.3±30.1 °C
Index of Refraction: 1.598
Molar Refractivity: 78.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 208.13
ACD/KOC (pH 5.5): 1577.79
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 213.22
ACD/KOC (pH 7.4): 1616.39
Polar Surface Area: 58 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 229.9±3.0 cm3

Click to predict properties on the Chemicalize site


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