MAGNESIUM VALPROATE

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Synonyms
Status
Molecule Category Salt-form
UNII Q400352CM2
EPA CompTox DTXSID0041062

Structure

InChI Key LKLLHOIUJVEAGU-UHFFFAOYSA-L
Smiles CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].[Mg+2]
InChI
InChI=1S/2C8H16O2.Mg/c2*1-3-5-7(6-4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H30MgO4
Molecular Weight 310.72
AlogP 2.29
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 37.3
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 10.0

Cross References

Resources Reference
ChEMBL CHEMBL2315212
FDA SRS Q400352CM2
SureChEMBL SCHEMBL69794
CONTENTS