magnesium;hydride;2-oxopropanedioic acid

C3H4MgO5 — CID 174763054

IUPACmagnesium;hydride;2-oxopropanedioic acid
SMILESO=C(O)C(=O)C(=O)O.[H-].[H-].[Mg+2]
InChIInChI=1S/C3H2O5.Mg.2H/c4-1(2(5)6)3(7)8;;;/h(H,5,6)(H,7,8);;;/q;+2;2*-1
InChIKeyPWVCLHNNWCULGA-UHFFFAOYSA-N
MW144.37 g/mol
LogP-1.43
Rot. Bonds2

About magnesium;hydride;2-oxopropanedioic acid

magnesium;hydride;2-oxopropanedioic acid (PubChem CID 174763054) has the molecular formula C3H4MgO5 and a molecular weight of 144.37 g/mol. Its IUPAC name is magnesium;hydride;2-oxopropanedioic acid.

Molecular Properties

Compound Namemagnesium;hydride;2-oxopropanedioic acid
PubChem CID174763054
Molecular FormulaC3H4MgO5
Molecular Weight144.37 g/mol
Exact Mass143.99
IUPAC Namemagnesium;hydride;2-oxopropanedioic acid
SMILESO=C(O)C(=O)C(=O)O.[H-].[H-].[Mg+2]
InChIInChI=1S/C3H2O5.Mg.2H/c4-1(2(5)6)3(7)8;;;/h(H,5,6)(H,7,8);;;/q;+2;2*-1
InChIKeyPWVCLHNNWCULGA-UHFFFAOYSA-N
XLogP-1.43
TPSA91.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.37
LogP ≤ 5-1.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

beryllium;hydride;2-oxopropanedioic acid
CID 174837448
cobalt;2-oxopropanedioic acid
CID 174542323
cerium;lanthanum;2-oxopropanedioic acid
CID 175276289
magnesium;carbonic acid;hydride
CID 173064498
trimagnesium;carbonic acid;hydride
CID 173236021
magnesium oxalic acid
CID 54611841
magnesium;carbonic acid;dibromide
CID 175416809
dimagnesium;carbonic acid;hydride;tetrahydrate
CID 173193239
magnesium;potassium;carbonic acid;hydride
CID 173403726
dicalcium;dimagnesium;carbonic acid;hydride
CID 174770084
hexamagnesium;alumane;carbonic acid;hydride
CID 173485627
magnesium;carbonic acid;hydride;trihydrate
CID 173024872

Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;2-oxopropanedioic acid?
The IUPAC name of magnesium;hydride;2-oxopropanedioic acid (CID 174763054) is magnesium;hydride;2-oxopropanedioic acid.
What is the SMILES notation for magnesium;hydride;2-oxopropanedioic acid?
The canonical SMILES for magnesium;hydride;2-oxopropanedioic acid is O=C(O)C(=O)C(=O)O.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;hydride;2-oxopropanedioic acid?
The InChIKey is PWVCLHNNWCULGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2O5.Mg.2H/c4-1(2(5)6)3(7)8;;;/h(H,5,6)(H,7,8);;;/q;+2;2*-1.
What are the key properties of magnesium;hydride;2-oxopropanedioic acid?
magnesium;hydride;2-oxopropanedioic acid has a molecular weight of 144.37 g/mol, XLogP of -1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;2-oxopropanedioic acid is sourced from PubChem (CID 174763054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).