4,4'-[(Phenylmethylene)bis[(2-methyl-p-phenylene)azo]]bis[2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one]

Base Information

• Chemical Name: 4,4'-[(Phenylmethylene)bis[(2-methyl-p-phenylene)azo]]bis[2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one]
• CAS No.: 66085-69-6
• Molecular Formula: C41H36N8O2
• Molecular Weight: 672.7769
• European Community (EC) Number: 266-130-7
• DSSTox Substance ID: DTXSID90886794
• Nikkaji Number: J92.393A

Synonyms:66085-69-6;EINECS 266-130-7;3H-Pyrazol-3-one, 4,4'-((phenylmethylene)bis((2-methyl-4,1-phenylene)-2,1-diazenediyl))bis(2,4-dihydro-5-methyl-2-phenyl-;3H-Pyrazol-3-one, 4,4'-((phenylmethylene)bis((2-methyl-4,1-phenylene)azo))bis(2,4-dihydro-5-methyl-2-phenyl-;3H-Pyrazol-3-one, 4,4'-[(phenylmethylene)bis[(2-methyl-4,1-phenylene)azo]]bis[2,4-dihydro-5-methyl-2-phenyl-;4,4'-[(Phenylmethylene)bis[(2-methyl-p-phenylene)azo]]bis[2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one];3H-Pyrazol-3-one, 4,4'-[(phenylmethylene)bis[(2-methyl-4,1-phenylene)-2,1-diazenediyl]]bis[2,4-dihydro-5-methyl-2-phenyl-;4,4'-((Phenylmethylene)bis((2-methyl-p-phenylene)azo))bis(2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one);DTXSID90886794;C41H36N8O2;C41-H36-N8-O2;4,4'-[(Phenylmethylene)bis[(2-methyl-4,1-phenylene)azo]]bis(2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one)

Chemical Property of 4,4'-[(Phenylmethylene)bis[(2-methyl-p-phenylene)azo]]bis[2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one]

Chemical Property:

• Boiling Point: 850.3°Cat760mmHg
• PKA: 1.73±0.70(Predicted)
• Flash Point: 468°C
• Density: 1.26g/cm³
• XLogP3: 8.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 672.29612242
• Heavy Atom Count: 51
• Complexity: 1250

Purity/Quality:

99% ^*data from raw suppliers

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• Canonical SMILES: CC1=C(C=CC(=C1)C(C2=CC=CC=C2)C3=CC(=C(C=C3)N=NC4C(=NN(C4=O)C5=CC=CC=C5)C)C)N=NC6C(=NN(C6=O)C7=CC=CC=C7)C

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