magnesium oxalic acid

C2H2MgO4+2 — CID 54611841

IUPACmagnesium oxalic acid
SMILESO=C(O)C(=O)O.[Mg+2]
InChIInChI=1S/C2H2O4.Mg/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2
InChIKeyUHNWOJJPXCYKCG-UHFFFAOYSA-N
MW114.34 g/mol
LogP-1.23
Rot. Bonds

About magnesium oxalic acid

magnesium oxalic acid (PubChem CID 54611841) has the molecular formula C2H2MgO4+2 and a molecular weight of 114.34 g/mol. Its IUPAC name is magnesium oxalic acid.

Molecular Properties

Compound Namemagnesium oxalic acid
PubChem CID54611841
Molecular FormulaC2H2MgO4+2
Molecular Weight114.34 g/mol
Exact Mass113.98
IUPAC Namemagnesium oxalic acid
SMILESO=C(O)C(=O)O.[Mg+2]
InChIInChI=1S/C2H2O4.Mg/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2
InChIKeyUHNWOJJPXCYKCG-UHFFFAOYSA-N
XLogP-1.23
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.34
LogP ≤ 5-1.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

oxalic acid;trihydrochloride
CID 140553783
californium;oxalic acid
CID 87427078
oxalic acid;hydrochloride
CID 173369286
oxalic acid;thorium
CID 25199595
europium;oxalic acid
CID 90472147
lithium;oxalic acid;chloride
CID 175547992
azane;oxalic acid;dihydrate
CID 173006602
oxalic acid;zirconium;hydrate
CID 91886498
indigane;λ2-stannane;oxalic acid
CID 175366280
oxalic acid;zinc;hydrate
CID 71311498
oxalic acid;yttrium;tetrahydrate
CID 173039711
oxalic acid;tantalum;hydrate
CID 174144106

Frequently Asked Questions

What is the IUPAC name of magnesium oxalic acid?
The IUPAC name of magnesium oxalic acid (CID 54611841) is magnesium oxalic acid.
What is the SMILES notation for magnesium oxalic acid?
The canonical SMILES for magnesium oxalic acid is O=C(O)C(=O)O.[Mg+2].
What is the InChIKey of magnesium oxalic acid?
The InChIKey is UHNWOJJPXCYKCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2O4.Mg/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2.
What are the key properties of magnesium oxalic acid?
magnesium oxalic acid has a molecular weight of 114.34 g/mol, XLogP of -1.23, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium oxalic acid is sourced from PubChem (CID 54611841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).