magnesium;benzene;oxygen(2-)

C6H6MgO — CID 172758407

IUPACmagnesium;benzene;oxygen(2-)
SMILES[Mg+2].[O-2].c1ccccc1
InChIInChI=1S/C6H6.Mg.O/c1-2-4-6-5-3-1;;/h1-6H;;/q;+2;-2
InChIKeyLIPKEIZQJKQUTI-UHFFFAOYSA-N
MW118.42 g/mol
LogP1.19
Rot. Bonds

About magnesium;benzene;oxygen(2-)

magnesium;benzene;oxygen(2-) (PubChem CID 172758407) has the molecular formula C6H6MgO and a molecular weight of 118.42 g/mol. Its IUPAC name is magnesium;benzene;oxygen(2-).

Molecular Properties

Compound Namemagnesium;benzene;oxygen(2-)
PubChem CID172758407
Molecular FormulaC6H6MgO
Molecular Weight118.42 g/mol
Exact Mass118.03
IUPAC Namemagnesium;benzene;oxygen(2-)
SMILES[Mg+2].[O-2].c1ccccc1
InChIInChI=1S/C6H6.Mg.O/c1-2-4-6-5-3-1;;/h1-6H;;/q;+2;-2
InChIKeyLIPKEIZQJKQUTI-UHFFFAOYSA-N
XLogP1.19
TPSA28.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.42
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

benzene
CID 21262180
(111C)cyclohexatriene
CID 172821629
benzene;dihydrochloride
CID 18003865
azane;benzene
CID 67859568
CID 57470889
CID 57470889
benzene chloride
CID 22259851
benzene;hydrofluoride
CID 66584548
CID 159867921
CID 159867921
benzene;helium
CID 71353422
CID 67279810
CID 67279810
benzene;silane
CID 158753213
benzene;hydroiodide
CID 69009885

Frequently Asked Questions

What is the IUPAC name of magnesium;benzene;oxygen(2-)?
The IUPAC name of magnesium;benzene;oxygen(2-) (CID 172758407) is magnesium;benzene;oxygen(2-).
What is the SMILES notation for magnesium;benzene;oxygen(2-)?
The canonical SMILES for magnesium;benzene;oxygen(2-) is [Mg+2].[O-2].c1ccccc1.
What is the InChIKey of magnesium;benzene;oxygen(2-)?
The InChIKey is LIPKEIZQJKQUTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6.Mg.O/c1-2-4-6-5-3-1;;/h1-6H;;/q;+2;-2.
What are the key properties of magnesium;benzene;oxygen(2-)?
magnesium;benzene;oxygen(2-) has a molecular weight of 118.42 g/mol, XLogP of 1.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;benzene;oxygen(2-) is sourced from PubChem (CID 172758407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).