3-methyl-2,6-dinitrobenzenesulfonic acid
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3-methyl-2,6-dinitrobenzenesulfonic acid
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CAS No:
63348-71-0
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Formula:
C7H6N2O7S
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Chemical Name:
3-methyl-2,6-dinitrobenzenesulfonic acid
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Synonyms:
2,4-Dinitrotoluene-3-sulfonic acid;63348-71-0;3-methyl-2,6-dinitrobenzenesulfonic acid;2,4-Dinitrotoluene-3-sulfonic acid sodium salt;2,4-DINITROTOLUENE-3-SULFONICACIDSODIUMSALT;CCRIS 9294;SCHEMBL2314823;DTXSID40979483;ZINC2525026;Toluene-3-sulfonic acid, 2,4-dinitro-;3-Methyl-2,6-dinitrobenzene-1-sulfonic acid
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CAS No:
Computed Properties
Molecular Weight:262.20
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:261.98957171
Monoisotopic Mass:261.98957171
Topological Polar Surface Area:154
Heavy Atom Count:17
Complexity:417
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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