magnesium bis(3-methoxyphenolate)

C14H14MgO4 — CID 10858575

IUPACmagnesium bis(3-methoxyphenolate)
SMILESCOc1cccc([O-])c1.COc1cccc([O-])c1.[Mg+2]
InChIInChI=1S/2C7H8O2.Mg/c2*1-9-7-4-2-3-6(8)5-7;/h2*2-5,8H,1H3;/q;;+2/p-2
InChIKeyYTAURYICCYOTOZ-UHFFFAOYSA-L
MW270.57 g/mol
LogP1.16
Rot. Bonds2

About magnesium bis(3-methoxyphenolate)

magnesium bis(3-methoxyphenolate) (PubChem CID 10858575) has the molecular formula C14H14MgO4 and a molecular weight of 270.57 g/mol. Its IUPAC name is magnesium bis(3-methoxyphenolate).

Molecular Properties

Compound Namemagnesium bis(3-methoxyphenolate)
PubChem CID10858575
Molecular FormulaC14H14MgO4
Molecular Weight270.57 g/mol
Exact Mass270.07
IUPAC Namemagnesium bis(3-methoxyphenolate)
SMILESCOc1cccc([O-])c1.COc1cccc([O-])c1.[Mg+2]
InChIInChI=1S/2C7H8O2.Mg/c2*1-9-7-4-2-3-6(8)5-7;/h2*2-5,8H,1H3;/q;;+2/p-2
InChIKeyYTAURYICCYOTOZ-UHFFFAOYSA-L
XLogP1.16
TPSA64.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.57
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

azane;1,3-dimethoxybenzene
CID 70210283
tris(1,3-dimethoxybenzene);phosphane
CID 160853878
CID 172849383
CID 172849383
carbanide;1,3-dimethoxybenzene;rubidium(1+)
CID 160752391
calcium;1,3-dimethoxybenzene;hydride
CID 174808068
1,3-dimethoxybenzene;1,4-dimethoxybenzene
CID 91359455
CID 139245906
CID 139245906
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
trisodium;2-ethoxyphenolate;4-ethoxyphenolate;3-methoxyphenolate
CID 172755779
sodium 6-methoxynaphthalen-2-olate
CID 25112534
bis(3-methoxyphenyl)borinic acid
CID 153354662

Frequently Asked Questions

What is the IUPAC name of magnesium bis(3-methoxyphenolate)?
The IUPAC name of magnesium bis(3-methoxyphenolate) (CID 10858575) is magnesium bis(3-methoxyphenolate).
What is the SMILES notation for magnesium bis(3-methoxyphenolate)?
The canonical SMILES for magnesium bis(3-methoxyphenolate) is COc1cccc([O-])c1.COc1cccc([O-])c1.[Mg+2].
What is the InChIKey of magnesium bis(3-methoxyphenolate)?
The InChIKey is YTAURYICCYOTOZ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C7H8O2.Mg/c2*1-9-7-4-2-3-6(8)5-7;/h2*2-5,8H,1H3;/q;;+2/p-2.
What are the key properties of magnesium bis(3-methoxyphenolate)?
magnesium bis(3-methoxyphenolate) has a molecular weight of 270.57 g/mol, XLogP of 1.16, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium bis(3-methoxyphenolate) is sourced from PubChem (CID 10858575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).