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129042-81-5

129042-81-5 structural image
Product Name: 3-(3-HYDROXY-4-METHOXYPHENYL)-DL-BETA-ALANINE
Formula: C10H13NO4
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COMPUTED DESCRIPTORS

Molecular Weight 211.21 g/mol
XLogP3 -2.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 211.08445790 g/mol
Monoisotopic Mass 211.08445790 g/mol
Topological Polar Surface Area 92.8 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 222
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