aluminum;calcium;sodium;hexafluoride;hydrate

H2AlCaF6NaO — CID 173241770

IUPACaluminum;calcium;sodium;hexafluoride;hydrate
SMILESO.[Al+3].[Ca+2].[F-].[F-].[F-].[F-].[F-].[F-].[Na+]
InChIInChI=1S/Al.Ca.6FH.Na.H2O/h;;6*1H;;1H2/q+3;+2;;;;;;;+1;/p-6
InChIKeyCUCIVTGZGLUSAW-UHFFFAOYSA-H
MW222.05 g/mol
LogP-22.56
Rot. Bonds

About aluminum;calcium;sodium;hexafluoride;hydrate

aluminum;calcium;sodium;hexafluoride;hydrate (PubChem CID 173241770) has the molecular formula H2AlCaF6NaO and a molecular weight of 222.05 g/mol. Its IUPAC name is aluminum;calcium;sodium;hexafluoride;hydrate.

Molecular Properties

Compound Namealuminum;calcium;sodium;hexafluoride;hydrate
PubChem CID173241770
Molecular FormulaH2AlCaF6NaO
Molecular Weight222.05 g/mol
Exact Mass221.93
IUPAC Namealuminum;calcium;sodium;hexafluoride;hydrate
SMILESO.[Al+3].[Ca+2].[F-].[F-].[F-].[F-].[F-].[F-].[Na+]
InChIInChI=1S/Al.Ca.6FH.Na.H2O/h;;6*1H;;1H2/q+3;+2;;;;;;;+1;/p-6
InChIKeyCUCIVTGZGLUSAW-UHFFFAOYSA-H
XLogP-22.56
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.05
LogP ≤ 5-22.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of aluminum;calcium;sodium;hexafluoride;hydrate?
The IUPAC name of aluminum;calcium;sodium;hexafluoride;hydrate (CID 173241770) is aluminum;calcium;sodium;hexafluoride;hydrate.
What is the SMILES notation for aluminum;calcium;sodium;hexafluoride;hydrate?
The canonical SMILES for aluminum;calcium;sodium;hexafluoride;hydrate is O.[Al+3].[Ca+2].[F-].[F-].[F-].[F-].[F-].[F-].[Na+].
What is the InChIKey of aluminum;calcium;sodium;hexafluoride;hydrate?
The InChIKey is CUCIVTGZGLUSAW-UHFFFAOYSA-H. The full InChI is InChI=1S/Al.Ca.6FH.Na.H2O/h;;6*1H;;1H2/q+3;+2;;;;;;;+1;/p-6.
What are the key properties of aluminum;calcium;sodium;hexafluoride;hydrate?
aluminum;calcium;sodium;hexafluoride;hydrate has a molecular weight of 222.05 g/mol, XLogP of -22.56, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;calcium;sodium;hexafluoride;hydrate is sourced from PubChem (CID 173241770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).