2-acetyloxybutanedioic acid
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2-acetyloxybutanedioic acid
structure -
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CAS No:
85319-64-8
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Formula:
C6H8O6
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Chemical Name:
2-acetyloxybutanedioic acid
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Synonyms:
2-acetyloxybutanedioic acid;acetylmalic acid;NSC30921;L-acetoxysuccinic acid;SCHEMBL581924;85319-64-8;NSC-30921
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CAS No:
Computed Properties
Molecular Weight:176.12
XLogP3:-0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:176.03208797
Monoisotopic Mass:176.03208797
Topological Polar Surface Area:101
Heavy Atom Count:12
Complexity:208
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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