ChemSpider 2D Image | (2E)-3-[3-(4-Bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-1-(2,4-dichlorophenyl)-2-propen-1-one | C24H15BrCl2N2O

(2E)-3-[3-(4-Bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-1-(2,4-dichlorophenyl)-2-propen-1-one

  • Molecular FormulaC24H15BrCl2N2O
  • Average mass498.199 Da
  • Monoisotopic mass495.974487 Da
  • ChemSpider ID30657122

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-[3-(4-Bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-1-(2,4-dichlorophenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-3-[3-(4-Bromophényl)-1-phényl-1H-pyrazol-4-yl]-1-(2,4-dichlorophényl)-2-propén-1-one [French] [ACD/IUPAC Name]
(2E)-3-[3-(4-Bromphenyl)-1-phenyl-1H-pyrazol-4-yl]-1-(2,4-dichlorphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
2-Propen-1-one, 3-[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]-1-(2,4-dichlorophenyl)-, (2E)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 650.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 347.2±31.5 °C
Index of Refraction: 1.653
Molar Refractivity: 127.6±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.92
ACD/LogD (pH 5.5): 6.79
ACD/BCF (pH 5.5): 85835.92
ACD/KOC (pH 5.5): 118331.42
ACD/LogD (pH 7.4): 6.79
ACD/BCF (pH 7.4): 85835.92
ACD/KOC (pH 7.4): 118331.42
Polar Surface Area: 35 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 348.6±7.0 cm3

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