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405294-73-7

405294-73-7 structural image
Product Name: 3-(4-BUTOXYPHENYL)-BETA-ALANINE
Formula: C13H19NO3
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COMPUTED DESCRIPTORS

Molecular Weight 237.29 g/mol
XLogP3 -0.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 237.13649347 g/mol
Monoisotopic Mass 237.13649347 g/mol
Topological Polar Surface Area 72.6 Ų
Heavy Atom Count 17
Formal Charge 0
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