2-[(2-Pyridinylmethyl)thio]-1H-benzimidazole-6-sulfonic acid
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![2-[(2-Pyridinylmethyl)thio]-1H-benzimidazole-6-sulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/821ced09cdb140b4a881c17b6b916b5c.png "2-[(2-Pyridinylmethyl)thio]-1H-benzimidazole-6-sulfonic acid")
2-[(2-Pyridinylmethyl)thio]-1H-benzimidazole-6-sulfonic acid
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CAS No:
28020-71-5
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Formula:
C13H11N3O3S2
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Chemical Name:
2-[(2-Pyridinylmethyl)thio]-1H-benzimidazole-6-sulfonic acid
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Synonyms:
1H-Benzimidazole-6-sulfonic acid,2-[(2-pyridinylmethyl)thio]-;5-Benzimidazolesulfonic acid,2-[(2-pyridylmethyl)thio]-;1H-Benzimidazole-5-sulfonic acid,2-[(2-pyridinylmethyl)thio]-;2-[(2-Pyridinylmethyl)thio]-1H-benzimidazole-6-sulfonic acid;2-(2-Pyridylmethylthio)-5-sulfobenzimidazole
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CAS No:
2-[(2-Pyridinylmethyl)thio]-1H-benzimidazole-6-sulfonic acid Basic Attributes
321.37500
321.37
248-782-4
DTXSID50182300
Computed Properties
Molecular Weight:321.4
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:321.02418357
Monoisotopic Mass:321.02418357
Topological Polar Surface Area:130
Heavy Atom Count:21
Complexity:454
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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