ChemSpider 2D Image | 4-Bromo-N-[(4-bromo-1,3-dimethyl-1H-pyrazol-5-yl)methyl]-3-methylaniline | C13H15Br2N3

4-Bromo-N-[(4-bromo-1,3-dimethyl-1H-pyrazol-5-yl)methyl]-3-methylaniline

  • Molecular FormulaC13H15Br2N3
  • Average mass373.086 Da
  • Monoisotopic mass370.963257 Da
  • ChemSpider ID49169636

More details:

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

1H-Pyrazole-5-methanamine, 4-bromo-N-(4-bromo-3-methylphenyl)-1,3-dimethyl- [ACD/Index Name]
4-Brom-N-[(4-brom-1,3-dimethyl-1H-pyrazol-5-yl)methyl]-3-methylanilin [German] [ACD/IUPAC Name]
4-Bromo-N-[(4-bromo-1,3-dimethyl-1H-pyrazol-5-yl)methyl]-3-methylaniline [ACD/IUPAC Name]
4-Bromo-N-[(4-bromo-1,3-diméthyl-1H-pyrazol-5-yl)méthyl]-3-méthylaniline [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: 449.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 225.8±28.7 °C
Index of Refraction: 1.640
Molar Refractivity: 82.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.29
ACD/LogD (pH 5.5): 4.22
ACD/BCF (pH 5.5): 941.18
ACD/KOC (pH 5.5): 4675.84
ACD/LogD (pH 7.4): 4.22
ACD/BCF (pH 7.4): 943.42
ACD/KOC (pH 7.4): 4686.94
Polar Surface Area: 30 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 227.6±7.0 cm3

Click to predict properties on the Chemicalize site


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