ChemSpider 2D Image | 4,4'-[(3,3'-Dichloro-4,4'-biphenyldiyl)di-2,1-diazenediyl]bis(5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one) | C32H24Cl2N8O2

4,4'-[(3,3'-Dichloro-4,4'-biphenyldiyl)di-2,1-diazenediyl]bis(5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one)

  • Molecular FormulaC32H24Cl2N8O2
  • Average mass623.491 Da
  • Monoisotopic mass622.139954 Da
  • ChemSpider ID21171908

More details:

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

222-530-3 [EINECS]
3H-Pyrazol-3-one, 4,4'-[(3,3'-dichloro[1,1'-biphenyl]-4,4'-diyl)di-2,1-diazenediyl]bis[2,4-dihydro-5-methyl-2-phenyl- [ACD/Index Name]
4,4'-[(3,3'-Dichlor-4,4'-biphenyldiyl)di-2,1-diazendiyl]bis(5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-on) [German] [ACD/IUPAC Name]
4,4'-[(3,3'-Dichloro-4,4'-biphenyldiyl)di-2,1-diazenediyl]bis(5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one) [ACD/IUPAC Name]
4,4'-[(3,3'-Dichloro-4,4'-biphényldiyl)di-2,1-diazènediyl]bis(5-méthyl-2-phényl-2,4-dihydro-3H-pyrazol-3-one) [French] [ACD/IUPAC Name]
4,4'-[(3,3'-Dichlorobiphenyl-4,4'-diyl)didiazene-2,1-diyl]bis(5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one)
3520-72-7 [RN]
4,4'-[(3,3'-dichloro[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 825.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 120.0±3.0 kJ/mol
Flash Point: 453.1±34.3 °C
Index of Refraction: 1.714
Molar Refractivity: 171.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 5.64
ACD/BCF (pH 5.5): 11297.91
ACD/KOC (pH 5.5): 27714.78
ACD/LogD (pH 7.4): 5.64
ACD/BCF (pH 7.4): 11299.15
ACD/KOC (pH 7.4): 27717.82
Polar Surface Area: 115 Å2
Polarizability: 68.0±0.5 10-24cm3
Surface Tension: 57.3±7.0 dyne/cm
Molar Volume: 436.8±7.0 cm3

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