magnesium bis(tetra(propan-2-yloxy)alumanuide)

C24H56Al2MgO8 — CID 16707867

IUPACmagnesium bis(tetra(propan-2-yloxy)alumanuide)
SMILESCC(C)O[Al-](OC(C)C)(OC(C)C)OC(C)C.CC(C)O[Al-](OC(C)C)(OC(C)C)OC(C)C.[Mg+2]
InChIInChI=1S/8C3H7O.2Al.Mg/c8*1-3(2)4;;;/h8*3H,1-2H3;;;/q8*-1;2*+3;+2
InChIKeyJGPFUTJMRMPGRB-UHFFFAOYSA-N
MW550.97 g/mol
LogP5.86
Rot. Bonds16

About magnesium bis(tetra(propan-2-yloxy)alumanuide)

magnesium bis(tetra(propan-2-yloxy)alumanuide) (PubChem CID 16707867) has the molecular formula C24H56Al2MgO8 and a molecular weight of 550.97 g/mol. Its IUPAC name is magnesium bis(tetra(propan-2-yloxy)alumanuide).

Molecular Properties

Compound Namemagnesium bis(tetra(propan-2-yloxy)alumanuide)
PubChem CID16707867
Molecular FormulaC24H56Al2MgO8
Molecular Weight550.97 g/mol
Exact Mass550.35
IUPAC Namemagnesium bis(tetra(propan-2-yloxy)alumanuide)
SMILESCC(C)O[Al-](OC(C)C)(OC(C)C)OC(C)C.CC(C)O[Al-](OC(C)C)(OC(C)C)OC(C)C.[Mg+2]
InChIInChI=1S/8C3H7O.2Al.Mg/c8*1-3(2)4;;;/h8*3H,1-2H3;;;/q8*-1;2*+3;+2
InChIKeyJGPFUTJMRMPGRB-UHFFFAOYSA-N
XLogP5.86
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds16
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500550.97
LogP ≤ 55.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of magnesium bis(tetra(propan-2-yloxy)alumanuide)?
The IUPAC name of magnesium bis(tetra(propan-2-yloxy)alumanuide) (CID 16707867) is magnesium bis(tetra(propan-2-yloxy)alumanuide).
What is the SMILES notation for magnesium bis(tetra(propan-2-yloxy)alumanuide)?
The canonical SMILES for magnesium bis(tetra(propan-2-yloxy)alumanuide) is CC(C)O[Al-](OC(C)C)(OC(C)C)OC(C)C.CC(C)O[Al-](OC(C)C)(OC(C)C)OC(C)C.[Mg+2].
What is the InChIKey of magnesium bis(tetra(propan-2-yloxy)alumanuide)?
The InChIKey is JGPFUTJMRMPGRB-UHFFFAOYSA-N. The full InChI is InChI=1S/8C3H7O.2Al.Mg/c8*1-3(2)4;;;/h8*3H,1-2H3;;;/q8*-1;2*+3;+2.
What are the key properties of magnesium bis(tetra(propan-2-yloxy)alumanuide)?
magnesium bis(tetra(propan-2-yloxy)alumanuide) has a molecular weight of 550.97 g/mol, XLogP of 5.86, 16 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium bis(tetra(propan-2-yloxy)alumanuide) is sourced from PubChem (CID 16707867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).