4-Hydroxy-5-(((methylphenyl)sulphonyl)amino)naphthalene-2,7-disulphonic acid

Base Information

• Chemical Name: 4-Hydroxy-5-(((methylphenyl)sulphonyl)amino)naphthalene-2,7-disulphonic acid
• CAS No.: 71750-41-9
• Molecular Formula: C17H15 N O9 S3
• Molecular Weight: 473.4973
• European Community (EC) Number: 275-972-4
• DSSTox Substance ID: DTXSID50992380
• Wikidata: Q82982502
• Mol file: 71750-41-9.mol

Synonyms:71750-41-9;EINECS 275-972-4;4-Hydroxy-5-(((methylphenyl)sulphonyl)amino)naphthalene-2,7-disulphonic acid;4-hydroxy-5-[[(methylphenyl)sulphonyl]amino]naphthalene-2,7-disulphonic acid;DTXSID50992380;4-Hydroxy-5-[(2-methylbenzene-1-sulfonyl)amino]naphthalene-2,7-disulfonic acid

Chemical Property of 4-Hydroxy-5-(((methylphenyl)sulphonyl)amino)naphthalene-2,7-disulphonic acid

Chemical Property:

• PSA: 200.28000
• Density: 1.734g/cm³
• LogP: 5.46340
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 5
• Exact Mass: 472.99089458
• Heavy Atom Count: 30
• Complexity: 930

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

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