Magnesium citrate nonahydrate

Catalog Number	ACM153531965-1
CAS	153531-96-5
Structure
Synonyms	Trimagnesium dicitrate nonahydrate
Molecular Weight	613.25
Molecular Formula	C12H28Mg3O23
Canonical SMILES	C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.O.O.O.O.O.O.O.[Mg+2].[Mg+2].[Mg+2]
InChI	InChI=1S/2C6H8O7.3Mg.9H2O/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);9*1H2/q;3*+2;/p-6
InChI Key	IYQJAGXFXWIEJE-UHFFFAOYSA-H
Purity	98%
Exact Mass	612.0572622
Hydrogen Bond Acceptor Count	23
Hydrogen Bond Donor Count	11
Monoisotopic Mass	612.0572622
Rotatable Bond Count	4
Topological Polar Surface Area	290