lanthanum(3+);carbonate;hydroxide;hydrate

CH3LaO5 — CID 173093313

IUPAClanthanum(3+);carbonate;hydroxide;hydrate
SMILESO.O=C([O-])[O-].[La+3].[OH-]
InChIInChI=1S/CH2O3.La.2H2O/c2-1(3)4;;;/h(H2,2,3,4);;2*1H2/q;+3;;/p-3
InChIKeyORHQXOJKIXYRMA-UHFFFAOYSA-K
MW233.94 g/mol
LogP-3.45
Rot. Bonds

About lanthanum(3+);carbonate;hydroxide;hydrate

lanthanum(3+);carbonate;hydroxide;hydrate (PubChem CID 173093313) has the molecular formula CH3LaO5 and a molecular weight of 233.94 g/mol. Its IUPAC name is lanthanum(3+);carbonate;hydroxide;hydrate.

Molecular Properties

Compound Namelanthanum(3+);carbonate;hydroxide;hydrate
PubChem CID173093313
Molecular FormulaCH3LaO5
Molecular Weight233.94 g/mol
Exact Mass233.90
IUPAC Namelanthanum(3+);carbonate;hydroxide;hydrate
SMILESO.O=C([O-])[O-].[La+3].[OH-]
InChIInChI=1S/CH2O3.La.2H2O/c2-1(3)4;;;/h(H2,2,3,4);;2*1H2/q;+3;;/p-3
InChIKeyORHQXOJKIXYRMA-UHFFFAOYSA-K
XLogP-3.45
TPSA124.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.94
LogP ≤ 5-3.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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magnesium;carbonate;pentahydrate
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cobalt;carbonate;hydroxide
CID 5362494
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sodium;lanthanum(3+);dicarbonate
CID 14550042
dimagnesium;dicarbonate;hydrate
CID 157388040
bis(neodymium(3+));tricarbonate;decahydrate
CID 163951984
calcium;carbonate;hydrate
CID 23282065

Frequently Asked Questions

What is the IUPAC name of lanthanum(3+);carbonate;hydroxide;hydrate?
The IUPAC name of lanthanum(3+);carbonate;hydroxide;hydrate (CID 173093313) is lanthanum(3+);carbonate;hydroxide;hydrate.
What is the SMILES notation for lanthanum(3+);carbonate;hydroxide;hydrate?
The canonical SMILES for lanthanum(3+);carbonate;hydroxide;hydrate is O.O=C([O-])[O-].[La+3].[OH-].
What is the InChIKey of lanthanum(3+);carbonate;hydroxide;hydrate?
The InChIKey is ORHQXOJKIXYRMA-UHFFFAOYSA-K. The full InChI is InChI=1S/CH2O3.La.2H2O/c2-1(3)4;;;/h(H2,2,3,4);;2*1H2/q;+3;;/p-3.
What are the key properties of lanthanum(3+);carbonate;hydroxide;hydrate?
lanthanum(3+);carbonate;hydroxide;hydrate has a molecular weight of 233.94 g/mol, XLogP of -3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for lanthanum(3+);carbonate;hydroxide;hydrate is sourced from PubChem (CID 173093313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).