aluminum;lithium;sulfate

AlLiO4S+2 — CID 23446975

IUPACaluminum;lithium;sulfate
SMILESO=S(=O)([O-])[O-].[Al+3].[Li+]
InChIInChI=1S/Al.Li.H2O4S/c;;1-5(2,3)4/h;;(H2,1,2,3,4)/q+3;+1;/p-2
InChIKeyCRAMPRSVKPPGJF-UHFFFAOYSA-L
MW129.99 g/mol
LogP-4.71
Rot. Bonds

About aluminum;lithium;sulfate

aluminum;lithium;sulfate (PubChem CID 23446975) has the molecular formula AlLiO4S+2 and a molecular weight of 129.99 g/mol. Its IUPAC name is aluminum;lithium;sulfate.

Molecular Properties

Compound Namealuminum;lithium;sulfate
PubChem CID23446975
Molecular FormulaAlLiO4S+2
Molecular Weight129.99 g/mol
Exact Mass129.95
IUPAC Namealuminum;lithium;sulfate
SMILESO=S(=O)([O-])[O-].[Al+3].[Li+]
InChIInChI=1S/Al.Li.H2O4S/c;;1-5(2,3)4/h;;(H2,1,2,3,4)/q+3;+1;/p-2
InChIKeyCRAMPRSVKPPGJF-UHFFFAOYSA-L
XLogP-4.71
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.99
LogP ≤ 5-4.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of aluminum;lithium;sulfate?
The IUPAC name of aluminum;lithium;sulfate (CID 23446975) is aluminum;lithium;sulfate.
What is the SMILES notation for aluminum;lithium;sulfate?
The canonical SMILES for aluminum;lithium;sulfate is O=S(=O)([O-])[O-].[Al+3].[Li+].
What is the InChIKey of aluminum;lithium;sulfate?
The InChIKey is CRAMPRSVKPPGJF-UHFFFAOYSA-L. The full InChI is InChI=1S/Al.Li.H2O4S/c;;1-5(2,3)4/h;;(H2,1,2,3,4)/q+3;+1;/p-2.
What are the key properties of aluminum;lithium;sulfate?
aluminum;lithium;sulfate has a molecular weight of 129.99 g/mol, XLogP of -4.71, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;lithium;sulfate is sourced from PubChem (CID 23446975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).