ChemSpider 2D Image | 1-[3,5-Bis(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(diethylamino)ethanone | C21H23Cl2N3O

1-[3,5-Bis(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(diethylamino)ethanone

  • Molecular FormulaC21H23Cl2N3O
  • Average mass404.333 Da
  • Monoisotopic mass403.121826 Da
  • ChemSpider ID22698209

More details:

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

1-[3,5-Bis(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(diethylamino)ethanone [ACD/IUPAC Name]
1-[3,5-Bis(2-chlorophényl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(diéthylamino)éthanone [French] [ACD/IUPAC Name]
1-[3,5-Bis(2-chlorphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(diethylamino)ethanon [German] [ACD/IUPAC Name]
Ethanone, 1-[3,5-bis(2-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(diethylamino)- [ACD/Index 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: 501.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 257.4±32.9 °C
Index of Refraction: 1.607
Molar Refractivity: 112.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.95
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 3.39
ACD/KOC (pH 5.5): 13.10
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 120.58
ACD/KOC (pH 7.4): 465.78
Polar Surface Area: 36 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 43.8±7.0 dyne/cm
Molar Volume: 325.5±7.0 cm3

Click to predict properties on the Chemicalize site


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