Aluminium chloride hexahydrateProduct ingredient for Aluminum chloride

Name
Aluminium chloride hexahydrate
Drug Entry
Aluminum chloride

Aluminum chloride is a chemical compound with the chemical formula AlCl3. When contaminated with iron chloride, it often displays a yellow color compared to the white pure compound. It is used in various chemical applications as a Lewis base, with anhydrous aluminium trichloride being the most commonly used Lewis acid. It may also be found in over-the-counter as an antiperspirant or prescription products as an antihemorrhagic agent. In antiperspirant products, FDA approves the use of aluminum chloride as an active ingredient up to 15%, calculated on the hexahydrate form, in an aqueous solution nonaerosol dosage form 4.

Accession Number
DBSALT001526
Structure
Thumb
Synonyms
Aluminium chloride
UNII
3CYT62D3GA
CAS Number
7784-13-6
Weight
Average: 241.432
Monoisotopic: 239.951484678
Chemical Formula
AlCl3H12O6
InChI Key
JGDITNMASUZKPW-UHFFFAOYSA-K
InChI
InChI=1S/Al.3ClH.6H2O/h;3*1H;6*1H2/q+3;;;;;;;;;/p-3
IUPAC Name
trichloroalumane hexahydrate
SMILES
O.O.O.O.O.O.Cl[Al](Cl)Cl
ChemSpider
22970
ChEBI
30115
ChEMBL
CHEMBL3833314
Wikipedia
Aluminium_chloride
Predicted Properties
PropertyValueSource
logP1.65ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 Å2ChemAxon
Rotatable Bond Count0ChemAxon
Refractivity18.41 m3·mol-1ChemAxon
Polarizability9.49 Å3ChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon