2-methyl-5-oxohex-3-enedioic acid
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2-methyl-5-oxohex-3-enedioic acid
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CAS No:
6918-07-6
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Formula:
C7H8O5
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Chemical Name:
2-methyl-5-oxohex-3-enedioic acid
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Synonyms:
6918-07-6;2-methyl-5-oxohex-3-enedioic acid;DTXSID30331571
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CAS No:
Computed Properties
Molecular Weight:172.13
XLogP3:0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:172.03717335
Monoisotopic Mass:172.03717335
Topological Polar Surface Area:91.7
Heavy Atom Count:12
Complexity:240
Undefined Atom Stereocenter Count:1
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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