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13984-53-7

13984-53-7 structural image
Product Name: METHYL 4-ACETYL-5-OXOHEXANOATE
Formula: C9H14O4
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COMPUTED DESCRIPTORS

Molecular Weight 186.20 g/mol
XLogP3 0
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 186.08920892 g/mol
Monoisotopic Mass 186.08920892 g/mol
Topological Polar Surface Area 60.4 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 206
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