4-((4,8-Disulpho-2-naphthyl)azo)-3-hydroxy-2-naphthoic acid

Base Information

• Chemical Name: 4-((4,8-Disulpho-2-naphthyl)azo)-3-hydroxy-2-naphthoic acid
• CAS No.: 84030-35-3
• Molecular Formula: C21H14 N2 O9 S2
• Molecular Weight: 502.47386
• European Community (EC) Number: 281-808-2
• DSSTox Substance ID: DTXSID001133046
• Nikkaji Number: J297.447I
• Mol file: 84030-35-3.mol

Synonyms:84030-35-3;EINECS 281-808-2;4-((4,8-Disulpho-2-naphthyl)azo)-3-hydroxy-2-naphthoic acid;C21H14N2O9S2;C21-H14-N2-O9-S2;4-[(4,8-disulpho-2-naphthyl)azo]-3-hydroxy-2-naphthoic acid;4-[(4,8-Disulfo-2-naphthyl)azo]-3-hydroxy-2-naphthoic acid;DTXSID001133046;4-[(4,8-Disulfo-2-naphthalenyl)azo]-3-hydroxy-2-naphthalenecarboxylic acid;4-[2-(4,8-Disulfo-2-naphthalenyl)diazenyl]-3-hydroxy-2-naphthalenecarboxylic acid

Chemical Property of 4-((4,8-Disulpho-2-naphthyl)azo)-3-hydroxy-2-naphthoic acid

Chemical Property:

• PSA: 0.00000
• Density: 1.717g/cm³
• LogP: 0.00000
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 5
• Exact Mass: 502.01407238
• Heavy Atom Count: 34
• Complexity: 1000

Purity/Quality:

98%Min ^*data from raw suppliers

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(C(=C2N=NC3=CC4=C(C=CC=C4S(=O)(=O)O)C(=C3)S(=O)(=O)O)O)C(=O)O

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