ChemSpider 2D Image | Methyl 1-[(E)-[(4-methoxyphenyl)imino](phenyl)methyl]-5-methyl-1H-pyrazole-3-carboxylate | C20H19N3O3

Methyl 1-[(E)-[(4-methoxyphenyl)imino](phenyl)methyl]-5-methyl-1H-pyrazole-3-carboxylate

  • Molecular FormulaC20H19N3O3
  • Average mass349.383 Da
  • Monoisotopic mass349.142639 Da
  • ChemSpider ID115296019

More details:

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

1-[(E)-[(4-Méthoxyphényl)imino](phényl)méthyl]-5-méthyl-1H-pyrazole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
1H-Pyrazole-3-carboxylic acid, 1-[(E)-[(4-methoxyphenyl)imino]phenylmethyl]-5-methyl-, methyl ester [ACD/Index Name]
Methyl 1-[(E)-[(4-methoxyphenyl)imino](phenyl)methyl]-5-methyl-1H-pyrazole-3-carboxylate [ACD/IUPAC Name]
Methyl-1-[(E)-[(4-methoxyphenyl)imino](phenyl)methyl]-5-methyl-1H-pyrazol-3-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 528.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.4±3.0 kJ/mol
Flash Point: 273.7±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 100.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 3.78
ACD/BCF (pH 5.5): 437.65
ACD/KOC (pH 5.5): 2704.72
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 437.67
ACD/KOC (pH 7.4): 2704.79
Polar Surface Area: 66 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 42.4±7.0 dyne/cm
Molar Volume: 296.8±7.0 cm3

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