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Search term: SMBPCDDKDVJHMX (Found by InChIKey (skeleton match))

ChemSpider 2D Image | N'-[(Z)-(4-Bromo-2,6-dichlorophenyl)methylene]-1-(3-methylbenzyl)-3-(2-methyl-2-propanyl)-1H-pyrazole-5-carbohydrazide | C23H23BrCl2N4O

N'-[(Z)-(4-Bromo-2,6-dichlorophenyl)methylene]-1-(3-methylbenzyl)-3-(2-methyl-2-propanyl)-1H-pyrazole-5-carbohydrazide

  • Molecular FormulaC23H23BrCl2N4O
  • Average mass522.265 Da
  • Monoisotopic mass520.043213 Da
  • ChemSpider ID101456116
  • Double-bond stereo - Double-bond stereo


More details:






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

1H-Pyrazole-5-carboxylic acid, 3-(1,1-dimethylethyl)-1-[(3-methylphenyl)methyl]-, 2-[(1Z)-(4-bromo-2,6-dichlorophenyl)methylene]hydrazide [ACD/Index Name]
N'-[(Z)-(4-Brom-2,6-dichlorphenyl)methylen]-1-(3-methylbenzyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-carbohydrazid [German] [ACD/IUPAC Name]
N'-[(Z)-(4-Bromo-2,6-dichlorophenyl)methylene]-1-(3-methylbenzyl)-3-(2-methyl-2-propanyl)-1H-pyrazole-5-carbohydrazide [ACD/IUPAC Name]
N'-[(Z)-(4-Bromo-2,6-dichlorophényl)méthylène]-1-(3-méthylbenzyl)-3-(2-méthyl-2-propanyl)-1H-pyrazole-5-carbohydrazide [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.624
Molar Refractivity: 131.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.29
ACD/LogD (pH 5.5): 6.86
ACD/BCF (pH 5.5): 95543.00
ACD/KOC (pH 5.5): 127762.48
ACD/LogD (pH 7.4): 6.86
ACD/BCF (pH 7.4): 95517.93
ACD/KOC (pH 7.4): 127728.96
Polar Surface Area: 59 Å2
Polarizability: 52.1±0.5 10-24cm3
Surface Tension: 44.8±7.0 dyne/cm
Molar Volume: 372.3±7.0 cm3

Click to predict properties on the Chemicalize site






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