aluminum;lithium;carbonate;sulfate

CAlLiO7S — CID 159509946

IUPACaluminum;lithium;carbonate;sulfate
SMILESO=C([O-])[O-].O=S(=O)([O-])[O-].[Al+3].[Li+]
InChIInChI=1S/CH2O3.Al.Li.H2O4S/c2-1(3)4;;;1-5(2,3)4/h(H2,2,3,4);;;(H2,1,2,3,4)/q;+3;+1;/p-4
InChIKeyMALVSSZHDCUVLZ-UHFFFAOYSA-J
MW189.99 g/mol
LogP-7.16
Rot. Bonds

About aluminum;lithium;carbonate;sulfate

aluminum;lithium;carbonate;sulfate (PubChem CID 159509946) has the molecular formula CAlLiO7S and a molecular weight of 189.99 g/mol. Its IUPAC name is aluminum;lithium;carbonate;sulfate.

Molecular Properties

Compound Namealuminum;lithium;carbonate;sulfate
PubChem CID159509946
Molecular FormulaCAlLiO7S
Molecular Weight189.99 g/mol
Exact Mass189.93
IUPAC Namealuminum;lithium;carbonate;sulfate
SMILESO=C([O-])[O-].O=S(=O)([O-])[O-].[Al+3].[Li+]
InChIInChI=1S/CH2O3.Al.Li.H2O4S/c2-1(3)4;;;1-5(2,3)4/h(H2,2,3,4);;;(H2,1,2,3,4)/q;+3;+1;/p-4
InChIKeyMALVSSZHDCUVLZ-UHFFFAOYSA-J
XLogP-7.16
TPSA143.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.99
LogP ≤ 5-7.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of aluminum;lithium;carbonate;sulfate?
The IUPAC name of aluminum;lithium;carbonate;sulfate (CID 159509946) is aluminum;lithium;carbonate;sulfate.
What is the SMILES notation for aluminum;lithium;carbonate;sulfate?
The canonical SMILES for aluminum;lithium;carbonate;sulfate is O=C([O-])[O-].O=S(=O)([O-])[O-].[Al+3].[Li+].
What is the InChIKey of aluminum;lithium;carbonate;sulfate?
The InChIKey is MALVSSZHDCUVLZ-UHFFFAOYSA-J. The full InChI is InChI=1S/CH2O3.Al.Li.H2O4S/c2-1(3)4;;;1-5(2,3)4/h(H2,2,3,4);;;(H2,1,2,3,4)/q;+3;+1;/p-4.
What are the key properties of aluminum;lithium;carbonate;sulfate?
aluminum;lithium;carbonate;sulfate has a molecular weight of 189.99 g/mol, XLogP of -7.16, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;lithium;carbonate;sulfate is sourced from PubChem (CID 159509946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).