SILICATE(2-), HEXAFLUORO-, DISODIUM, REACTION PRODUCTS WITH LITHIUM MAGNESIUM SODIUM SILICATE

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Keyword(s): Food Contact Chemicals
Molecule Category Salt-form
EPA CompTox DTXSID30234174

Structure

InChI Key AZJYLVAUMGUUBL-UHFFFAOYSA-A
Smiles [F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].O=[Si]=O.O=[Si]=O.O=[Si]=O.[O-][Si]12O[Si]3([O-])O[Si]([O-])(O1)O[Si]([O-])(O2)O3.[O-][Si]12O[Si]3([O-])O[Si]([O-])(O1)O[Si]([O-])(O2)O3.[O-][Si]12O[Si]3([O-])O[Si]([O-])(O1)O[Si]([O-])(O2)O3.[O-][Si]12O[Si]3([O-])O[Si]([O-])(O1)O[Si]([O-])(O2)O3.[O-][Si]12O[Si]3([O-])O[Si]([O-])(O1)O[Si]([O-])(O2)O3.[O-][Si]12O[Si]3([O-])O[Si]([O-])(O1)O[Si]([O-])(O2)O3
InChI
InChI=1S/18FH.16Mg.10Na.6O10Si4.3O2Si/c;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;6*1-11-5-12(2)8-13(3,6-11)10-14(4,7-11)9-12;3*1-3-2/h18*1H;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;16*+2;10*+1;6*-4;;;/p-18

Physicochemical Descriptors

Property Name Value
Molecular Formula F18Mg16Na10O66Si27
Molecular Weight 2766.67
AlogP -131.97
Hydrogen Bond Acceptor 66.0
Polar Surface Area 988.14
Heavy Atoms 137.0

Cross References

Resources Reference
CAS NUMBER 85085-18-3
NORMAN SUSDAT
PubChem 71587314
CONTENTS