6-Nitro-1-benzothiophene-2-carboxylic acid
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6-Nitro-1-benzothiophene-2-carboxylic acid
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CAS No:
19983-42-7
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Formula:
C9H5NO4S
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Chemical Name:
6-Nitro-1-benzothiophene-2-carboxylic acid
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Synonyms:
6-nitrobenzothiophene-2-carboxylic acid;
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CAS No:
6-Nitro-1-benzothiophene-2-carboxylic acid Basic Attributes
223.20500
222.99392881
DTXSID80574113
2934999090
Computed Properties
Molecular Weight:223.21
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:222.99392881
Monoisotopic Mass:222.99392881
Topological Polar Surface Area:111
Heavy Atom Count:15
Complexity:290
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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