magnesium;diethylalumanylium;tris(propan-2-olate)

C13H31AlMgO3 — CID 18786649

IUPACmagnesium;diethylalumanylium;tris(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].CC[Al+]CC.[Mg+2]
InChIInChI=1S/3C3H7O.2C2H5.Al.Mg/c3*1-3(2)4;2*1-2;;/h3*3H,1-2H3;2*1H2,2H3;;/q3*-1;;;+1;+2
InChIKeySVBVLGJKDKZDLP-UHFFFAOYSA-N
MW286.67 g/mol
LogP0.45
Rot. Bonds2

About magnesium;diethylalumanylium;tris(propan-2-olate)

magnesium;diethylalumanylium;tris(propan-2-olate) (PubChem CID 18786649) has the molecular formula C13H31AlMgO3 and a molecular weight of 286.67 g/mol. Its IUPAC name is magnesium;diethylalumanylium;tris(propan-2-olate).

Molecular Properties

Compound Namemagnesium;diethylalumanylium;tris(propan-2-olate)
PubChem CID18786649
Molecular FormulaC13H31AlMgO3
Molecular Weight286.67 g/mol
Exact Mass286.19
IUPAC Namemagnesium;diethylalumanylium;tris(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].CC[Al+]CC.[Mg+2]
InChIInChI=1S/3C3H7O.2C2H5.Al.Mg/c3*1-3(2)4;2*1-2;;/h3*3H,1-2H3;2*1H2,2H3;;/q3*-1;;;+1;+2
InChIKeySVBVLGJKDKZDLP-UHFFFAOYSA-N
XLogP0.45
TPSA69.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.67
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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pentakis(propan-2-olate);tungsten
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Frequently Asked Questions

What is the IUPAC name of magnesium;diethylalumanylium;tris(propan-2-olate)?
The IUPAC name of magnesium;diethylalumanylium;tris(propan-2-olate) (CID 18786649) is magnesium;diethylalumanylium;tris(propan-2-olate).
What is the SMILES notation for magnesium;diethylalumanylium;tris(propan-2-olate)?
The canonical SMILES for magnesium;diethylalumanylium;tris(propan-2-olate) is CC(C)[O-].CC(C)[O-].CC(C)[O-].CC[Al+]CC.[Mg+2].
What is the InChIKey of magnesium;diethylalumanylium;tris(propan-2-olate)?
The InChIKey is SVBVLGJKDKZDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/3C3H7O.2C2H5.Al.Mg/c3*1-3(2)4;2*1-2;;/h3*3H,1-2H3;2*1H2,2H3;;/q3*-1;;;+1;+2.
What are the key properties of magnesium;diethylalumanylium;tris(propan-2-olate)?
magnesium;diethylalumanylium;tris(propan-2-olate) has a molecular weight of 286.67 g/mol, XLogP of 0.45, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;diethylalumanylium;tris(propan-2-olate) is sourced from PubChem (CID 18786649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).