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54561-75-0

54561-75-0 structural image
Product Name: Propanedioic acid, 2-(phenylmethyl)-, 1-methyl ester
Formula: C11H12O4
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COMPUTED DESCRIPTORS

Molecular Weight 207.20 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 207.06573383 g/mol
Monoisotopic Mass 207.06573383 g/mol
Topological Polar Surface Area 66.4 Ų
Heavy Atom Count 15
Formal Charge -1
Complexity 225
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes