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131644-96-7

131644-96-7 structural image
Product Name: 4-(2-METHOXY-PHENYL)-3-OXO-BUTYRIC ACID METHYL ESTER
Formula: C12H14O4
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COMPUTED DESCRIPTORS

Molecular Weight 222.24 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 222.08920892 g/mol
Monoisotopic Mass 222.08920892 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 249
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