aluminum;magnesium;sulfate;heptahydrate

H14AlMgO11S+3 — CID 158341070

IUPACaluminum;magnesium;sulfate;heptahydrate
SMILESO.O.O.O.O.O.O.O=S(=O)([O-])[O-].[Al+3].[Mg+2]
InChIInChI=1S/Al.Mg.H2O4S.7H2O/c;;1-5(2,3)4;;;;;;;/h;;(H2,1,2,3,4);7*1H2/q+3;+2;;;;;;;;/p-2
InChIKeyGRDYAIDYPXFQQV-UHFFFAOYSA-L
MW273.45 g/mol
LogP-7.87
Rot. Bonds

About aluminum;magnesium;sulfate;heptahydrate

aluminum;magnesium;sulfate;heptahydrate (PubChem CID 158341070) has the molecular formula H14AlMgO11S+3 and a molecular weight of 273.45 g/mol. Its IUPAC name is aluminum;magnesium;sulfate;heptahydrate.

Molecular Properties

Compound Namealuminum;magnesium;sulfate;heptahydrate
PubChem CID158341070
Molecular FormulaH14AlMgO11S+3
Molecular Weight273.45 g/mol
Exact Mass272.99
IUPAC Namealuminum;magnesium;sulfate;heptahydrate
SMILESO.O.O.O.O.O.O.O=S(=O)([O-])[O-].[Al+3].[Mg+2]
InChIInChI=1S/Al.Mg.H2O4S.7H2O/c;;1-5(2,3)4;;;;;;;/h;;(H2,1,2,3,4);7*1H2/q+3;+2;;;;;;;;/p-2
InChIKeyGRDYAIDYPXFQQV-UHFFFAOYSA-L
XLogP-7.87
TPSA300.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.45
LogP ≤ 5-7.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

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Related Compounds

pentaaluminum;decamagnesium;hentriacontahydroxide;disulfate;hydrate
CID 122706784
dialuminum;trisulfate;dotriacontahydrate
CID 172707347
dialuminum;trisulfate;hexatriacontahydrate
CID 173430533
dialuminum;trisulfate;tetrahydrate
CID 169423459
dialuminum;trisulfate;decahydrate
CID 157389097
dimagnesium;dipotassium;trisulfate;hexahydrate
CID 24848855
oxovanadium(2+);sulfate;dihydrate
CID 19884450
sulfate trihydrate
CID 22613957
aluminum;lithium;sulfate
CID 23446975
dialuminum;dipotassium;hydride;trisulfate;dihydrate
CID 173094004
bis(cerium(3+));trisulfate;pentahydrate
CID 57370410
aluminum;gadolinium(3+);trisulfate
CID 159047443

Frequently Asked Questions

What is the IUPAC name of aluminum;magnesium;sulfate;heptahydrate?
The IUPAC name of aluminum;magnesium;sulfate;heptahydrate (CID 158341070) is aluminum;magnesium;sulfate;heptahydrate.
What is the SMILES notation for aluminum;magnesium;sulfate;heptahydrate?
The canonical SMILES for aluminum;magnesium;sulfate;heptahydrate is O.O.O.O.O.O.O.O=S(=O)([O-])[O-].[Al+3].[Mg+2].
What is the InChIKey of aluminum;magnesium;sulfate;heptahydrate?
The InChIKey is GRDYAIDYPXFQQV-UHFFFAOYSA-L. The full InChI is InChI=1S/Al.Mg.H2O4S.7H2O/c;;1-5(2,3)4;;;;;;;/h;;(H2,1,2,3,4);7*1H2/q+3;+2;;;;;;;;/p-2.
What are the key properties of aluminum;magnesium;sulfate;heptahydrate?
aluminum;magnesium;sulfate;heptahydrate has a molecular weight of 273.45 g/mol, XLogP of -7.87, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;magnesium;sulfate;heptahydrate is sourced from PubChem (CID 158341070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).