1,4-Benzenedicarboxylic acid, 2,5-bis(2-benzothiazolyl)-

Base Information

• Chemical Name: 1,4-Benzenedicarboxylic acid, 2,5-bis(2-benzothiazolyl)-
• CAS No.: 116967-65-8
• Molecular Formula: C22H12N2O4S2
• DSSTox Substance ID: DTXSID20392873
• Wikidata: Q82191347
• Mol file: 116967-65-8.mol

Synonyms:1,4-Benzenedicarboxylic acid, 2,5-bis(2-benzothiazolyl)-;116967-65-8;DTXSID20392873;SR-01000390464;SR-01000390464-1

Chemical Property of 1,4-Benzenedicarboxylic acid, 2,5-bis(2-benzothiazolyl)-

Chemical Property:

• XLogP3: 5.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 432.02384922
• Heavy Atom Count: 30
• Complexity: 624

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3C(=O)O)C4=NC5=CC=CC=C5S4)C(=O)O

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