3,3-dimethyl-2-oxobutane-1-sulfonic acid
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3,3-dimethyl-2-oxobutane-1-sulfonic acid
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CAS No:
72458-59-4
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Formula:
C6H12O4S
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Chemical Name:
3,3-dimethyl-2-oxobutane-1-sulfonic acid
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Synonyms:
3,3-dimethyl-2-oxo-butane-1-sulfonic acid;NSC231338;3,3-dimethyl-2-oxobutane-1-sulfonic acid;ZINC1759586;72458-59-4;3,3-Dimethyl-2-oxo-1-butanesulfonic acid
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CAS No:
Computed Properties
Molecular Weight:180.22
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:180.04563003
Monoisotopic Mass:180.04563003
Topological Polar Surface Area:79.8
Heavy Atom Count:11
Complexity:239
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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