magnesium ethanolate

C4H10MgO2 — CID 3693605

IUPACmagnesium ethanolate
SMILESCC[O-].CC[O-].[Mg+2]
InChIInChI=1S/2C2H5O.Mg/c2*1-2-3;/h2*2H2,1H3;/q2*-1;+2
InChIKeyXDKQUSKHRIUJEO-UHFFFAOYSA-N
MW114.43 g/mol
LogP-1.65
Rot. Bonds

About magnesium ethanolate

magnesium ethanolate (PubChem CID 3693605) has the molecular formula C4H10MgO2 and a molecular weight of 114.43 g/mol. Its IUPAC name is magnesium ethanolate.

Molecular Properties

Compound Namemagnesium ethanolate
PubChem CID3693605
Molecular FormulaC4H10MgO2
Molecular Weight114.43 g/mol
Exact Mass114.05
IUPAC Namemagnesium ethanolate
SMILESCC[O-].CC[O-].[Mg+2]
InChIInChI=1S/2C2H5O.Mg/c2*1-2-3;/h2*2H2,1H3;/q2*-1;+2
InChIKeyXDKQUSKHRIUJEO-UHFFFAOYSA-N
XLogP-1.65
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.43
LogP ≤ 5-1.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze magnesium ethanolate 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 ethanolate?
The IUPAC name of magnesium ethanolate (CID 3693605) is magnesium ethanolate.
What is the SMILES notation for magnesium ethanolate?
The canonical SMILES for magnesium ethanolate is CC[O-].CC[O-].[Mg+2].
What is the InChIKey of magnesium ethanolate?
The InChIKey is XDKQUSKHRIUJEO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H5O.Mg/c2*1-2-3;/h2*2H2,1H3;/q2*-1;+2.
What are the key properties of magnesium ethanolate?
magnesium ethanolate has a molecular weight of 114.43 g/mol, XLogP of -1.65, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium ethanolate is sourced from PubChem (CID 3693605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).