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33400-61-2

33400-61-2 structural image
Product Name: TERT-BUTYL 3-OXOPENTANOATE
Formula: C9H16O3
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COMPUTED DESCRIPTORS

Molecular Weight 172.22 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 172.109944368 g/mol
Monoisotopic Mass 172.109944368 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 177
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