Brilliant Purpurin R

Base Information

• Chemical Name: Brilliant Purpurin R
• CAS No.: 25188-31-2
• Molecular Formula: C34H28N6O9S3
• European Community (EC) Number: 607-618-5,611-099-0
• NSC Number: 7815
• DSSTox Substance ID: DTXSID501023622
• ChEMBL ID: CHEMBL1092077
• Mol file: 25188-31-2.mol

Synonyms:C.I. Direct Red 15;CHEMBL1092077;NSC-7815;C.I. Direct Red 15, trisodium salt;Brilliant Purpurin R;C.I. Direct Red 15 trisodium salt;Brilliant Purpurine R;Tertrodirect Scarlet PR;2,7-Naphthalenedisulfonic acid, 3-amino-4-[[4'-[(1-amino-4-sulfo-2-naphthalenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-, trisodium salt;SCHEMBL7804546;SCHEMBL14418367;NSC7815;DTXSID501023622;BDBM50316063;C.I. 23510;2, 3-amino-4-[[4'-[(1-amino-4-sulfo-2-naphthalenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-, trisodium salt;25188-31-2;3-amino-4-((4''-((1-amino-4-sulfonaphthalen-2-yl)diazenyl)biphenyl-4-yl)diazenyl)naphthalene-2,7-disulfonic acid

Chemical Property of Brilliant Purpurin R

Chemical Property:

• XLogP3: 5.8
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 8
• Exact Mass: 760.10799001
• Heavy Atom Count: 52
• Complexity: 1650

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• Canonical SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3N)S(=O)(=O)O)S(=O)(=O)O)C)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)O)N

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