938-54-5 Purity
>98.0%(GC)(T)
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The molecular formula of 2-Aminobenzothiazole-6-carboxylic acid is C8H6N2O2S.
The molecular weight of 2-Aminobenzothiazole-6-carboxylic acid is 194.21 g/mol.
The IUPAC name of 2-Aminobenzothiazole-6-carboxylic acid is 2-amino-1,3-benzothiazole-6-carboxylic acid.
The InChI of 2-Aminobenzothiazole-6-carboxylic acid is InChI=1S/C8H6N2O2S/c9-8-10-5-2-1-4(7(11)12)3-6(5)13-8/h1-3H,(H2,9,10)(H,11,12).
The InChIKey of 2-Aminobenzothiazole-6-carboxylic acid is ZEAKWWWXCZMODH-UHFFFAOYSA-N.
The canonical SMILES of 2-Aminobenzothiazole-6-carboxylic acid is C1=CC2=C(C=C1C(=O)O)SC(=N2)N.
The CAS number of 2-Aminobenzothiazole-6-carboxylic acid is 93-85-6.
The European Community (EC) number of 2-Aminobenzothiazole-6-carboxylic acid is 202-283-8.
The ChEMBL ID of 2-Aminobenzothiazole-6-carboxylic acid is CHEMBL394974.
Yes, 2-Aminobenzothiazole-6-carboxylic acid is a canonicalized compound.
Reference: [1] Patent: US2009/123373, 2009, A1, . Location in patent: Page/Page column 14-15
Reference: [1] Patent: EP2354136, 2011, A1, . Location in patent: Page/Page column 16
Reference: [1] Synlett, 2012, vol. 23, # 15, p. 2219 - 2222
[2] Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1991, vol. 30, # 5, p. 494 - 498
[3] Patent: WO2010/62171, 2010, A2, . Location in patent: Page/Page column 156
[4] Bioorganic and Medicinal Chemistry Letters, 2015, vol. 25, # 23, p. 5561 - 5565
[5] Patent: KR2018/81285, 2018, A, . Location in patent: Paragraph 0132; 0144-0147
Reference: [1]Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan,1946,vol. 66,p. Ausg. B, S. 75
Chem.Abstr.,1952,p. 112
Reference: [1]Zhurnal Obshchei Khimii,1959,vol. 29,p. 2068,2070; engl. Ausg. S. 2036, 2037
Reference: [1]Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan,1946,vol. 66,p. Ausg. B, S. 75
Chem.Abstr.,1952,p. 112
* For details of the synthesis route, please refer to the original source to ensure accuracy.