chloroaluminum(2+) sulfate

AlClO4S — CID 175267695

IUPACchloroaluminum(2+) sulfate
SMILESO=S(=O)([O-])[O-].[Al+2]Cl
InChIInChI=1S/Al.ClH.H2O4S/c;;1-5(2,3)4/h;1H;(H2,1,2,3,4)/q+3;;/p-3
InChIKeyQFRFLEUHMQFCIL-UHFFFAOYSA-K
MW158.50 g/mol
LogP-1.03
Rot. Bonds

About chloroaluminum(2+) sulfate

chloroaluminum(2+) sulfate (PubChem CID 175267695) has the molecular formula AlClO4S and a molecular weight of 158.50 g/mol. Its IUPAC name is chloroaluminum(2+) sulfate.

Molecular Properties

Compound Namechloroaluminum(2+) sulfate
PubChem CID175267695
Molecular FormulaAlClO4S
Molecular Weight158.50 g/mol
Exact Mass157.90
IUPAC Namechloroaluminum(2+) sulfate
SMILESO=S(=O)([O-])[O-].[Al+2]Cl
InChIInChI=1S/Al.ClH.H2O4S/c;;1-5(2,3)4/h;1H;(H2,1,2,3,4)/q+3;;/p-3
InChIKeyQFRFLEUHMQFCIL-UHFFFAOYSA-K
XLogP-1.03
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.50
LogP ≤ 5-1.03
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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Related Compounds

beryllium;potassium;sulfate
CID 20841736
hexadecasilver;octasulfate
CID 174664647
silver;zinc;sulfate
CID 157447446
dicalcium;sulfate
CID 23431966
tris(vanadium);pentasulfate
CID 173042063
dilithium;cobalt;sulfate
CID 174060420
octaazanium;tetrasulfate
CID 86742620
CID 23615458
CID 23615458
aluminum;lithium;sulfate
CID 23446975
cerium trisulfate
CID 160867766
octacosacopper;pentasulfate
CID 173053964
azanium sulfate
CID 21225610

Frequently Asked Questions

What is the IUPAC name of chloroaluminum(2+) sulfate?
The IUPAC name of chloroaluminum(2+) sulfate (CID 175267695) is chloroaluminum(2+) sulfate.
What is the SMILES notation for chloroaluminum(2+) sulfate?
The canonical SMILES for chloroaluminum(2+) sulfate is O=S(=O)([O-])[O-].[Al+2]Cl.
What is the InChIKey of chloroaluminum(2+) sulfate?
The InChIKey is QFRFLEUHMQFCIL-UHFFFAOYSA-K. The full InChI is InChI=1S/Al.ClH.H2O4S/c;;1-5(2,3)4/h;1H;(H2,1,2,3,4)/q+3;;/p-3.
What are the key properties of chloroaluminum(2+) sulfate?
chloroaluminum(2+) sulfate has a molecular weight of 158.50 g/mol, XLogP of -1.03, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for chloroaluminum(2+) sulfate is sourced from PubChem (CID 175267695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).