2-Hydroxy-3-[(3-hydroxy-1,4-dioxo-2-naphthyl)-phenyl-methyl]naphthalene-1,4-dione

Base Information

• Chemical Name: 2-Hydroxy-3-[(3-hydroxy-1,4-dioxo-2-naphthyl)-phenyl-methyl]naphthalene-1,4-dione
• CAS No.: 106823-05-6
• Molecular Formula: C27H16O6
• Molecular Weight: 436.4123
• NSC Number: 92202
• DSSTox Substance ID: DTXSID90910129
• Nikkaji Number: J751.382H
• Wikidata: Q82879886
• ChEMBL ID: CHEMBL83651

Synonyms:NSC92202;NSC-92202;106823-05-6;DTXSID90910129;BDBM246591;3,3'-(Phenylmethylene)bis(2-hydroxy-1,4-naphthalenedione);3,3'-(phenylmethylene)bis(2-hydroxynaphthalene-1,4-dione);3,3'-(Phenylmethylene)bis(4-hydroxynaphthalene-1,2-dione);2-hydroxy-3-[(3-hydroxy-1,4-dioxo-2-naphthyl)-phenyl-methyl]naphthalene-1,4-dione

Chemical Property of 2-Hydroxy-3-[(3-hydroxy-1,4-dioxo-2-naphthyl)-phenyl-methyl]naphthalene-1,4-dione

Chemical Property:

• Boiling Point: 688.1°Cat760mmHg
• Flash Point: 383.9°C
• Density: 1.543g/cm³
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 436.09468823
• Heavy Atom Count: 33
• Complexity: 882

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• Canonical SMILES: C1=CC=C(C=C1)C(C2=C(C3=CC=CC=C3C(=O)C2=O)O)C4=C(C5=CC=CC=C5C(=O)C4=O)O

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