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1391051-99-2

1391051-99-2 structural image
Product Name: Labetalol IMpurity A
Formula: C19H23NO4
Synonyms: 2-Hydroxy-5-[1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]benzoic acid
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COMPUTED DESCRIPTORS

Molecular Weight 329.4 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 8
Exact Mass 329.16270821 g/mol
Monoisotopic Mass 329.16270821 g/mol
Topological Polar Surface Area 89.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 384
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes