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21861-32-5

21861-32-5 structural image
Product Name: AKOS BBS-00006159
Formula: C9H8O3
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COMPUTED DESCRIPTORS

Molecular Weight 164.16 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 164.047344113 g/mol
Monoisotopic Mass 164.047344113 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 202
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes