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212007-07-3

212007-07-3 structural image
Product Name: Acetic acid, 2-[4-(1-aminoethyl)-2-methoxyphenoxy]-, ethyl ester
Formula: C13H19NO4
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COMPUTED DESCRIPTORS

Molecular Weight 253.29 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 253.13140809 g/mol
Monoisotopic Mass 253.13140809 g/mol
Topological Polar Surface Area 70.8 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 259
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