magnesium;methanolate;acetate

C3H6MgO3 — CID 140982127

IUPACmagnesium;methanolate;acetate
SMILESCC(=O)[O-].C[O-].[Mg+2]
InChIInChI=1S/C2H4O2.CH3O.Mg/c1-2(3)4;1-2;/h1H3,(H,3,4);1H3;/q;-1;+2/p-1
InChIKeyMONLKAMRZWJODZ-UHFFFAOYSA-M
MW114.38 g/mol
LogP-2.65
Rot. Bonds

About magnesium;methanolate;acetate

magnesium;methanolate;acetate (PubChem CID 140982127) has the molecular formula C3H6MgO3 and a molecular weight of 114.38 g/mol. Its IUPAC name is magnesium;methanolate;acetate.

Molecular Properties

Compound Namemagnesium;methanolate;acetate
PubChem CID140982127
Molecular FormulaC3H6MgO3
Molecular Weight114.38 g/mol
Exact Mass114.02
IUPAC Namemagnesium;methanolate;acetate
SMILESCC(=O)[O-].C[O-].[Mg+2]
InChIInChI=1S/C2H4O2.CH3O.Mg/c1-2(3)4;1-2;/h1H3,(H,3,4);1H3;/q;-1;+2/p-1
InChIKeyMONLKAMRZWJODZ-UHFFFAOYSA-M
XLogP-2.65
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.38
LogP ≤ 5-2.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze magnesium;methanolate;acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of magnesium;methanolate;acetate?
The IUPAC name of magnesium;methanolate;acetate (CID 140982127) is magnesium;methanolate;acetate.
What is the SMILES notation for magnesium;methanolate;acetate?
The canonical SMILES for magnesium;methanolate;acetate is CC(=O)[O-].C[O-].[Mg+2].
What is the InChIKey of magnesium;methanolate;acetate?
The InChIKey is MONLKAMRZWJODZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H4O2.CH3O.Mg/c1-2(3)4;1-2;/h1H3,(H,3,4);1H3;/q;-1;+2/p-1.
What are the key properties of magnesium;methanolate;acetate?
magnesium;methanolate;acetate has a molecular weight of 114.38 g/mol, XLogP of -2.65, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;methanolate;acetate is sourced from PubChem (CID 140982127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).