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

Base Information

• Chemical Name: 1,4-Benzenedicarboxylic acid, 2-(2-benzothiazolyl)-
• CAS No.: 105219-07-6
• Molecular Formula: C15H9NO4S
• DSSTox Substance ID: DTXSID60401716
• Wikidata: Q82204941
• Mol file: 105219-07-6.mol

Synonyms:105219-07-6;ChemDiv3_000198;1,4-Benzenedicarboxylic acid, 2-(2-benzothiazolyl)-;HMS1473I22;2-benzthiazoleterephthalic acid;SCHEMBL9296572;2-benzothiazole terephthalic acid;DTXSID60401716;DGXLWTWFCBNANR-UHFFFAOYSA-N;CCG-15158;AKOS004912631;IDI1_019516;2-(Benzo[d]thiazol-2-yl)terephthalic acid;SR-01000390489;SR-01000390489-1

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

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 299.02522894
• Heavy Atom Count: 21
• Complexity: 430

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)C(=O)O)C(=O)O

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