hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate

H12F6Mg6O24Si6-6 — CID 71317436

IUPAChexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate
SMILESO.O.O.O.O.O.[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F
InChIInChI=1S/6FO3Si.6Mg.6H2O/c6*1-5(2,3)4;;;;;;;;;;;;/h;;;;;;;;;;;;6*1H2/q6*-3;6*+2;;;;;;
InChIKeyOMCKXQDHIVFTIP-UHFFFAOYSA-N
MW824.41 g/mol
LogP-28.40
Rot. Bonds

About hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate

hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate (PubChem CID 71317436) has the molecular formula H12F6Mg6O24Si6-6 and a molecular weight of 824.41 g/mol. Its IUPAC name is hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate.

Molecular Properties

Compound Namehexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate
PubChem CID71317436
Molecular FormulaH12F6Mg6O24Si6-6
Molecular Weight824.41 g/mol
Exact Mass821.74
IUPAC Namehexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate
SMILESO.O.O.O.O.O.[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F
InChIInChI=1S/6FO3Si.6Mg.6H2O/c6*1-5(2,3)4;;;;;;;;;;;;/h;;;;;;;;;;;;6*1H2/q6*-3;6*+2;;;;;;
InChIKeyOMCKXQDHIVFTIP-UHFFFAOYSA-N
XLogP-28.40
TPSA604.08 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500824.41
LogP ≤ 5-28.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate?
The IUPAC name of hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate (CID 71317436) is hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate.
What is the SMILES notation for hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate?
The canonical SMILES for hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate is O.O.O.O.O.O.[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.[O-][Si]([O-])([O-])F.
What is the InChIKey of hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate?
The InChIKey is OMCKXQDHIVFTIP-UHFFFAOYSA-N. The full InChI is InChI=1S/6FO3Si.6Mg.6H2O/c6*1-5(2,3)4;;;;;;;;;;;;/h;;;;;;;;;;;;6*1H2/q6*-3;6*+2;;;;;;.
What are the key properties of hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate?
hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate has a molecular weight of 824.41 g/mol, XLogP of -28.40, 0 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for hexamagnesium;hexakis(fluoro(trioxido)silane);hexahydrate is sourced from PubChem (CID 71317436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).