ChemSpider 2D Image | Methyl (2E)-3-{4-[(Z)-{[(4-bromo-3-methyl-1H-pyrazol-1-yl)acetyl]hydrazono}methyl]-3,5-difluorophenyl}acrylate | C17H15BrF2N4O3

Methyl (2E)-3-{4-[(Z)-{[(4-bromo-3-methyl-1H-pyrazol-1-yl)acetyl]hydrazono}methyl]-3,5-difluorophenyl}acrylate

  • Molecular FormulaC17H15BrF2N4O3
  • Average mass441.227 Da
  • Monoisotopic mass440.029541 Da
  • ChemSpider ID82015884

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-{4-[(Z)-{[2-(4-Bromo-3-méthyl-1H-pyrazol-1-yl)acétyl]hydrazono}méthyl]-3,5-difluorophényl}acrylate de méthyle [French] [ACD/IUPAC Name]
1H-Pyrazole-1-acetic acid, 4-bromo-3-methyl-, 2-[(1Z)-[2,6-difluoro-4-[(1E)-3-methoxy-3-oxo-1-propen-1-yl]phenyl]methylene]hydrazide [ACD/Index Name]
Methyl (2E)-3-{4-[(Z)-{[(4-bromo-3-methyl-1H-pyrazol-1-yl)acetyl]hydrazono}methyl]-3,5-difluorophenyl}acrylate [ACD/IUPAC Name]
Methyl-(2E)-3-{4-[(Z)-{[(4-brom-3-methyl-1H-pyrazol-1-yl)acetyl]hydrazono}methyl]-3,5-difluorphenyl}acrylat [German] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.593
Molar Refractivity: 98.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 222.35
ACD/KOC (pH 5.5): 1665.76
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 222.27
ACD/KOC (pH 7.4): 1665.18
Polar Surface Area: 86 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 44.6±7.0 dyne/cm
Molar Volume: 291.8±7.0 cm3

Click to predict properties on the Chemicalize site


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