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331717-42-1

331717-42-1 structural image
Product Name: DL-2-Hydroxyvaleric acid, sodium salt, hydrate, 98
Formula: C5H11NaO4
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COMPUTED DESCRIPTORS

Molecular Weight 117.12 g/mol
XLogP3 1.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 117.055169145 g/mol
Monoisotopic Mass 117.055169145 g/mol
Topological Polar Surface Area 60.4 Ų
Heavy Atom Count 8
Formal Charge -1
Complexity 74.2
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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