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126245-80-5

126245-80-5 structural image
Product Name: ETHYL-8-METHYL-7-OXONONANOATE
Formula: C12H22O3
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COMPUTED DESCRIPTORS

Molecular Weight 214.30 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 9
Exact Mass 214.15689456 g/mol
Monoisotopic Mass 214.15689456 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 197
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