ChemSpider 2D Image | (4Z)-4-{[(2,4-Dimethylphenyl)amino](phenyl)methylene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one | C25H23N3O

(4Z)-4-{[(2,4-Dimethylphenyl)amino](phenyl)methylene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

  • Molecular FormulaC25H23N3O
  • Average mass381.470 Da
  • Monoisotopic mass381.184113 Da
  • ChemSpider ID21178675

  • Double-bond stereo - Double-bond stereo

More details:

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

(4Z)-4-{[(2,4-Dimethylphenyl)amino](phenyl)methylen}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-on [German] [ACD/IUPAC Name]
(4Z)-4-{[(2,4-Dimethylphenyl)amino](phenyl)methylene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one [ACD/IUPAC Name]
(4Z)-4-{[(2,4-Diméthylphényl)amino](phényl)méthylène}-5-méthyl-2-phényl-2,4-dihydro-3H-pyrazol-3-one [French] [ACD/IUPAC Name]
3H-Pyrazol-3-one, 4-[[(2,4-dimethylphenyl)amino]phenylmethylene]-2,4-dihydro-5-methyl-2-phenyl-, (4Z)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 516.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±3.0 kJ/mol
Flash Point: 266.2±32.9 °C
Index of Refraction: 1.620
Molar Refractivity: 117.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.55
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 78.29
ACD/KOC (pH 5.5): 276.52
ACD/LogD (pH 7.4): 4.65
ACD/BCF (pH 7.4): 1736.57
ACD/KOC (pH 7.4): 6133.69
Polar Surface Area: 45 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 42.5±7.0 dyne/cm
Molar Volume: 335.6±7.0 cm3

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