2-methylsulfanyl-1,3-benzothiazole-5-sulfonic acid
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2-methylsulfanyl-1,3-benzothiazole-5-sulfonic acid
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CAS No:
25991-41-7
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Formula:
C8H7NO3S3
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Chemical Name:
2-methylsulfanyl-1,3-benzothiazole-5-sulfonic acid
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Synonyms:
25991-41-7;NSC158000;2-(methylsulfanyl)-1,3-benzothiazole-5-sulfonic acid;2-methylsulfanyl-1,3-benzothiazole-5-sulfonic acid;SCHEMBL6516847;DTXSID80948895;ZINC1601715;NSC-158000
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CAS No:
2-methylsulfanyl-1,3-benzothiazole-5-sulfonic acid Basic Attributes
261.3 g/mol
260.95880661 g/mol
158000
Computed Properties
Molecular Weight:261.3
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:260.95880661
Monoisotopic Mass:260.95880661
Topological Polar Surface Area:129
Heavy Atom Count:15
Complexity:327
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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