magnesium bis(2-ethylhexan-1-olate)

C16H34MgO2 — CID 11448946

IUPACmagnesium bis(2-ethylhexan-1-olate)
SMILESCCCCC(CC)C[O-].CCCCC(CC)C[O-].[Mg+2]
InChIInChI=1S/2C8H17O.Mg/c2*1-3-5-6-8(4-2)7-9;/h2*8H,3-7H2,1-2H3;/q2*-1;+2
InChIKeyKUDSXRPAVPTUDU-UHFFFAOYSA-N
MW282.75 g/mol
LogP2.75
Rot. Bonds10

About magnesium bis(2-ethylhexan-1-olate)

magnesium bis(2-ethylhexan-1-olate) (PubChem CID 11448946) has the molecular formula C16H34MgO2 and a molecular weight of 282.75 g/mol. Its IUPAC name is magnesium bis(2-ethylhexan-1-olate).

Molecular Properties

Compound Namemagnesium bis(2-ethylhexan-1-olate)
PubChem CID11448946
Molecular FormulaC16H34MgO2
Molecular Weight282.75 g/mol
Exact Mass282.24
IUPAC Namemagnesium bis(2-ethylhexan-1-olate)
SMILESCCCCC(CC)C[O-].CCCCC(CC)C[O-].[Mg+2]
InChIInChI=1S/2C8H17O.Mg/c2*1-3-5-6-8(4-2)7-9;/h2*8H,3-7H2,1-2H3;/q2*-1;+2
InChIKeyKUDSXRPAVPTUDU-UHFFFAOYSA-N
XLogP2.75
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.75
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of magnesium bis(2-ethylhexan-1-olate)?
The IUPAC name of magnesium bis(2-ethylhexan-1-olate) (CID 11448946) is magnesium bis(2-ethylhexan-1-olate).
What is the SMILES notation for magnesium bis(2-ethylhexan-1-olate)?
The canonical SMILES for magnesium bis(2-ethylhexan-1-olate) is CCCCC(CC)C[O-].CCCCC(CC)C[O-].[Mg+2].
What is the InChIKey of magnesium bis(2-ethylhexan-1-olate)?
The InChIKey is KUDSXRPAVPTUDU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H17O.Mg/c2*1-3-5-6-8(4-2)7-9;/h2*8H,3-7H2,1-2H3;/q2*-1;+2.
What are the key properties of magnesium bis(2-ethylhexan-1-olate)?
magnesium bis(2-ethylhexan-1-olate) has a molecular weight of 282.75 g/mol, XLogP of 2.75, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium bis(2-ethylhexan-1-olate) is sourced from PubChem (CID 11448946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).