Keyword(s): Food Contact Chemicals
Molecule Category Salt-form
EPA CompTox DTXSID10872573

Structure

InChI Key ROPDWRCJTIRLTR-UHFFFAOYSA-L
Smiles [Ca++].[O-]P(=O)=O.[O-]P(=O)=O
InChI
InChI=1S/Ca.2HO3P/c;2*1-4(2)3/h;2*(H,1,2,3)/q+2;;/p-2

Physicochemical Descriptors

Property Name Value
Molecular Formula CaO6P2
Molecular Weight 197.88
AlogP -1.51
Hydrogen Bond Acceptor 6.0
Polar Surface Area 114.4
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 13477-39-9
NORMAN SUSDAT
PubChem 16129693