2-[(Methylthio)methyl]-1H-benzimidazole-6-sulfonic acid
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![2-[(Methylthio)methyl]-1H-benzimidazole-6-sulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/548b35fee542487eb3b393b1ca6c7ec8.png "2-[(Methylthio)methyl]-1H-benzimidazole-6-sulfonic acid")
2-[(Methylthio)methyl]-1H-benzimidazole-6-sulfonic acid
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CAS No:
29490-03-7
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Formula:
C9H10N2O3S2
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Chemical Name:
2-[(Methylthio)methyl]-1H-benzimidazole-6-sulfonic acid
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Synonyms:
1H-Benzimidazole-6-sulfonic acid,2-[(methylthio)methyl]-;5-Benzimidazolesulfonic acid,2-[(methylthio)methyl]-;1H-Benzimidazole-5-sulfonic acid,2-[(methylthio)methyl]-;2-[(Methylthio)methyl]-1H-benzimidazole-6-sulfonic acid;2-Methylthiomethyl-5(6)-sulfobenzimidazole;2-Methylthiomethyl-5-sulfobenzimidazole;2-[(Methylthio)methyl]-1H-benzimidazole-5-sulphonic acid
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CAS No:
2-[(Methylthio)methyl]-1H-benzimidazole-6-sulfonic acid Basic Attributes
258.3 g/mol
258.32
249-665-0
DTXSID70183692
Computed Properties
Molecular Weight:258.3
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:258.01328453
Monoisotopic Mass:258.01328453
Topological Polar Surface Area:117
Heavy Atom Count:16
Complexity:341
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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