magnesium;ethanolate;propan-2-olate

C5H12MgO2 — CID 19433386

IUPACmagnesium;ethanolate;propan-2-olate
SMILESCC(C)[O-].CC[O-].[Mg+2]
InChIInChI=1S/C3H7O.C2H5O.Mg/c1-3(2)4;1-2-3;/h3H,1-2H3;2H2,1H3;/q2*-1;+2
InChIKeyGZYFWIMHXDLFDM-UHFFFAOYSA-N
MW128.45 g/mol
LogP-1.26
Rot. Bonds

About magnesium;ethanolate;propan-2-olate

magnesium;ethanolate;propan-2-olate (PubChem CID 19433386) has the molecular formula C5H12MgO2 and a molecular weight of 128.45 g/mol. Its IUPAC name is magnesium;ethanolate;propan-2-olate.

Molecular Properties

Compound Namemagnesium;ethanolate;propan-2-olate
PubChem CID19433386
Molecular FormulaC5H12MgO2
Molecular Weight128.45 g/mol
Exact Mass128.07
IUPAC Namemagnesium;ethanolate;propan-2-olate
SMILESCC(C)[O-].CC[O-].[Mg+2]
InChIInChI=1S/C3H7O.C2H5O.Mg/c1-3(2)4;1-2-3;/h3H,1-2H3;2H2,1H3;/q2*-1;+2
InChIKeyGZYFWIMHXDLFDM-UHFFFAOYSA-N
XLogP-1.26
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.45
LogP ≤ 5-1.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze magnesium;ethanolate;propan-2-olate 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;propan-2-olate?
The IUPAC name of magnesium;ethanolate;propan-2-olate (CID 19433386) is magnesium;ethanolate;propan-2-olate.
What is the SMILES notation for magnesium;ethanolate;propan-2-olate?
The canonical SMILES for magnesium;ethanolate;propan-2-olate is CC(C)[O-].CC[O-].[Mg+2].
What is the InChIKey of magnesium;ethanolate;propan-2-olate?
The InChIKey is GZYFWIMHXDLFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O.C2H5O.Mg/c1-3(2)4;1-2-3;/h3H,1-2H3;2H2,1H3;/q2*-1;+2.
What are the key properties of magnesium;ethanolate;propan-2-olate?
magnesium;ethanolate;propan-2-olate has a molecular weight of 128.45 g/mol, XLogP of -1.26, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;ethanolate;propan-2-olate is sourced from PubChem (CID 19433386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).