3-Methyl-5-nitrobenzo[b]thiophene-2-carboxylic acid
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![3-Methyl-5-nitrobenzo[b]thiophene-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/407a7198c5a443d8be637db2907187c6.png "3-Methyl-5-nitrobenzo[b]thiophene-2-carboxylic acid")
3-Methyl-5-nitrobenzo[b]thiophene-2-carboxylic acid
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CAS No:
17514-61-3
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Formula:
C10H7NO4S
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Chemical Name:
3-Methyl-5-nitrobenzo[b]thiophene-2-carboxylic acid
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Synonyms:
Benzo[b]thiophene-2-carboxylic acid,3-methyl-5-nitro-;3-Methyl-5-nitrobenzo[b]thiophene-2-carboxylic acid;NSC 108936;3-Methyl-5-nitro-1-benzothiophene-2-carboxylic acid
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CAS No:
3-Methyl-5-nitrobenzo[b]thiophene-2-carboxylic acid Basic Attributes
237.23 g/mol
237.23
108936
DTXSID70296357
Computed Properties
Molecular Weight:237.23
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:237.00957888
Monoisotopic Mass:237.00957888
Topological Polar Surface Area:111
Heavy Atom Count:16
Complexity:316
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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