magnesium;oxygen(2-);titanium(4+);carbonate

CMgO4Ti+2 — CID 159180122

IUPACmagnesium;oxygen(2-);titanium(4+);carbonate
SMILESO=C([O-])[O-].[Mg+2].[O-2].[Ti+4]
InChIInChI=1S/CH2O3.Mg.O.Ti/c2-1(3)4;;;/h(H2,2,3,4);;;/q;+2;-2;+4/p-2
InChIKeyKMTYBGNGOGOGQK-UHFFFAOYSA-L
MW148.18 g/mol
LogP-2.95
Rot. Bonds

About magnesium;oxygen(2-);titanium(4+);carbonate

magnesium;oxygen(2-);titanium(4+);carbonate (PubChem CID 159180122) has the molecular formula CMgO4Ti+2 and a molecular weight of 148.18 g/mol. Its IUPAC name is magnesium;oxygen(2-);titanium(4+);carbonate.

Molecular Properties

Compound Namemagnesium;oxygen(2-);titanium(4+);carbonate
PubChem CID159180122
Molecular FormulaCMgO4Ti+2
Molecular Weight148.18 g/mol
Exact Mass147.91
IUPAC Namemagnesium;oxygen(2-);titanium(4+);carbonate
SMILESO=C([O-])[O-].[Mg+2].[O-2].[Ti+4]
InChIInChI=1S/CH2O3.Mg.O.Ti/c2-1(3)4;;;/h(H2,2,3,4);;;/q;+2;-2;+4/p-2
InChIKeyKMTYBGNGOGOGQK-UHFFFAOYSA-L
XLogP-2.95
TPSA91.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.18
LogP ≤ 5-2.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

octakis(oxygen(2-));heptakis(titanium(4+));tetracarbonate;tetrahydroxide
CID 173431892
aluminum;oxygen(2-);titanium(4+);carbonate
CID 158416043
magnesium;carbonate;pentahydrate
CID 22723706
dimagnesium;dicarbonate;hydrate
CID 157388040
magnesium;chromium(3+);carbonate
CID 159907532
trimagnesium;hydrogen carbonate;dicarbonate
CID 173153250
barium(2+);iron(2+);oxygen(2-);carbonate
CID 158757075
cerium(4+);oxygen(2-);carbonate;hydrate
CID 159747762
magnesium;barium(2+);carbonate;hydroxide
CID 21449529
triacontamagnesium;carbonic acid;triacontacarbonate
CID 173337540
bis(rhodium(3+));tricarbonate
CID 71471414
hexadecasodium;octacarbonate
CID 141056250

Frequently Asked Questions

What is the IUPAC name of magnesium;oxygen(2-);titanium(4+);carbonate?
The IUPAC name of magnesium;oxygen(2-);titanium(4+);carbonate (CID 159180122) is magnesium;oxygen(2-);titanium(4+);carbonate.
What is the SMILES notation for magnesium;oxygen(2-);titanium(4+);carbonate?
The canonical SMILES for magnesium;oxygen(2-);titanium(4+);carbonate is O=C([O-])[O-].[Mg+2].[O-2].[Ti+4].
What is the InChIKey of magnesium;oxygen(2-);titanium(4+);carbonate?
The InChIKey is KMTYBGNGOGOGQK-UHFFFAOYSA-L. The full InChI is InChI=1S/CH2O3.Mg.O.Ti/c2-1(3)4;;;/h(H2,2,3,4);;;/q;+2;-2;+4/p-2.
What are the key properties of magnesium;oxygen(2-);titanium(4+);carbonate?
magnesium;oxygen(2-);titanium(4+);carbonate has a molecular weight of 148.18 g/mol, XLogP of -2.95, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;oxygen(2-);titanium(4+);carbonate is sourced from PubChem (CID 159180122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).