ChemSpider 2D Image | 4-[(Z)-{4-[(4-Chlorobenzyl)oxy]-3-methoxybenzylidene}amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one | C26H24ClN3O3

4-[(Z)-{4-[(4-Chlorobenzyl)oxy]-3-methoxybenzylidene}amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one

  • Molecular FormulaC26H24ClN3O3
  • Average mass461.940 Da
  • Monoisotopic mass461.150604 Da
  • ChemSpider ID30654985

  • Double-bond stereo - Double-bond stereo

More details:

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

3H-Pyrazol-3-one, 4-[[(1Z)-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylene]amino]-1,2-dihydro-1,5-dimethyl-2-phenyl- [ACD/Index Name]
4-[(Z)-{4-[(4-Chlorbenzyl)oxy]-3-methoxybenzyliden}amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-on [German] [ACD/IUPAC Name]
4-[(Z)-{4-[(4-Chlorobenzyl)oxy]-3-methoxybenzylidene}amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one [ACD/IUPAC Name]
4-[(Z)-{4-[(4-Chlorobenzyl)oxy]-3-méthoxybenzylidène}amino]-1,5-diméthyl-2-phényl-1,2-dihydro-3H-pyrazol-3-one [French] [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: 586.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.6±3.0 kJ/mol
Flash Point: 308.8±32.9 °C
Index of Refraction: 1.605
Molar Refractivity: 130.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 14.31
ACD/KOC (pH 5.5): 73.17
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 307.30
ACD/KOC (pH 7.4): 1570.67
Polar Surface Area: 54 Å2
Polarizability: 51.9±0.5 10-24cm3
Surface Tension: 43.8±7.0 dyne/cm
Molar Volume: 380.0±7.0 cm3

Click to predict properties on the Chemicalize site


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