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1391051-93-6

1391051-93-6 structural image
Product Name: JOOXCMJARBKPKM-STGVANJCSA-N
Formula: C5H8O3
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COMPUTED DESCRIPTORS

Molecular Weight 119.09 g/mol
XLogP3 -0.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 119.05740862 g/mol
Monoisotopic Mass 119.05740862 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 106
Isotope Atom Count 3
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