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80003-58-3

80003-58-3 structural image
Product Name: 2-oxohex-5-enoic acid
Formula: C6H8O3
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COMPUTED DESCRIPTORS

Molecular Weight 128.13 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 128.047344113 g/mol
Monoisotopic Mass 128.047344113 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 137
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes