Keyword(s): Food Contact Chemicals
Molecule Category Salt-form
EPA CompTox DTXSID6051223

Structure

InChI Key SZQKIMURETYSEU-UHFFFAOYSA-N
Smiles [Ca++].[Ca++].[O-][Al]([O-])O[Al]([O-])[O-]
InChI
InChI=1S/2Al.2Ca.5O/q;;2*+2;;4*-1

Physicochemical Descriptors

Property Name Value
Molecular Formula Al2Ca2O5
Molecular Weight 213.86
AlogP -2.12
Hydrogen Bond Acceptor 4.0
Polar Surface Area 142.5
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 12042-78-3
NORMAN SUSDAT
PubChem 138394842