2,8-Phenoxathiindicarboxylic acid

Base Information

• Chemical Name: 2,8-Phenoxathiindicarboxylic acid
• CAS No.: 4667-25-8
• Molecular Formula: C14H8O5S
• DSSTox Substance ID: DTXSID10605500
• Nikkaji Number: J803.034K
• Wikidata: Q82503781
• Mol file: 4667-25-8.mol

Synonyms:PHENOXATHIINE-2,8-DICARBOXYLIC ACID;4667-25-8;2,8-Phenoxathiindicarboxylic acid;DTXSID10605500;phenoxathiin-2,8-dicarboxylic acid

Chemical Property of 2,8-Phenoxathiindicarboxylic acid

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 288.00924453
• Heavy Atom Count: 20
• Complexity: 376

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1C(=O)O)SC3=C(O2)C=CC(=C3)C(=O)O

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