magnesium;cerium(3+);octadecanoate;oxygen(2-)

C18H35CeMgO3+2 — CID 160620488

IUPACmagnesium;cerium(3+);octadecanoate;oxygen(2-)
SMILESCCCCCCCCCCCCCCCCCC(=O)[O-].[Ce+3].[Mg+2].[O-2]
InChIInChI=1S/C18H36O2.Ce.Mg.O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;;;/h2-17H2,1H3,(H,19,20);;;/q;+3;+2;-2/p-1
InChIKeyGIEXQPDALFOIKG-UHFFFAOYSA-M
MW463.90 g/mol
LogP4.50
Rot. Bonds16

About magnesium;cerium(3+);octadecanoate;oxygen(2-)

magnesium;cerium(3+);octadecanoate;oxygen(2-) (PubChem CID 160620488) has the molecular formula C18H35CeMgO3+2 and a molecular weight of 463.90 g/mol. Its IUPAC name is magnesium;cerium(3+);octadecanoate;oxygen(2-).

Molecular Properties

Compound Namemagnesium;cerium(3+);octadecanoate;oxygen(2-)
PubChem CID160620488
Molecular FormulaC18H35CeMgO3+2
Molecular Weight463.90 g/mol
Exact Mass463.15
IUPAC Namemagnesium;cerium(3+);octadecanoate;oxygen(2-)
SMILESCCCCCCCCCCCCCCCCCC(=O)[O-].[Ce+3].[Mg+2].[O-2]
InChIInChI=1S/C18H36O2.Ce.Mg.O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;;;/h2-17H2,1H3,(H,19,20);;;/q;+3;+2;-2/p-1
InChIKeyGIEXQPDALFOIKG-UHFFFAOYSA-M
XLogP4.50
TPSA68.63 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.90
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

magnesium bis(undecanoate)
CID 87902169
dimagnesium;octadecanoate
CID 19105820
magnesium;docosanoate;octadecanoate
CID 158868243
cerium(3+);tris(heptadecanoate)
CID 109374153
dimagnesium bis(octadecanoate)
CID 19043233
dimagnesium;tetrakis(octanoate)
CID 160745729
trimagnesium;tris(octadecanoate)
CID 159626374
cerium(3+);octanoate
CID 21123895
cerium(3+);lanthanum(3+);hexakis(octadecanoate)
CID 159422181
magnesium;octanoate;chloride
CID 172837629
CID 23623890
CID 23623890
octadecanoate
CID 3033836

Frequently Asked Questions

What is the IUPAC name of magnesium;cerium(3+);octadecanoate;oxygen(2-)?
The IUPAC name of magnesium;cerium(3+);octadecanoate;oxygen(2-) (CID 160620488) is magnesium;cerium(3+);octadecanoate;oxygen(2-).
What is the SMILES notation for magnesium;cerium(3+);octadecanoate;oxygen(2-)?
The canonical SMILES for magnesium;cerium(3+);octadecanoate;oxygen(2-) is CCCCCCCCCCCCCCCCCC(=O)[O-].[Ce+3].[Mg+2].[O-2].
What is the InChIKey of magnesium;cerium(3+);octadecanoate;oxygen(2-)?
The InChIKey is GIEXQPDALFOIKG-UHFFFAOYSA-M. The full InChI is InChI=1S/C18H36O2.Ce.Mg.O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;;;/h2-17H2,1H3,(H,19,20);;;/q;+3;+2;-2/p-1.
What are the key properties of magnesium;cerium(3+);octadecanoate;oxygen(2-)?
magnesium;cerium(3+);octadecanoate;oxygen(2-) has a molecular weight of 463.90 g/mol, XLogP of 4.50, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;cerium(3+);octadecanoate;oxygen(2-) is sourced from PubChem (CID 160620488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).