potassium;sulfo sulfate;sulfuric acid

H3KO11S3 — CID 158562224

IUPACpotassium;sulfo sulfate;sulfuric acid
SMILESO=S(=O)(O)O.O=S(=O)([O-])OS(=O)(=O)O.[K+]
InChIInChI=1S/K.H2O7S2.H2O4S/c;1-8(2,3)7-9(4,5)6;1-5(2,3)4/h;(H,1,2,3)(H,4,5,6);(H2,1,2,3,4)/q+1;;/p-1
InChIKeyHRAIBBFAAYBESA-UHFFFAOYSA-M
MW314.31 g/mol
LogP-5.38
Rot. Bonds2

About potassium;sulfo sulfate;sulfuric acid

potassium;sulfo sulfate;sulfuric acid (PubChem CID 158562224) has the molecular formula H3KO11S3 and a molecular weight of 314.31 g/mol. Its IUPAC name is potassium;sulfo sulfate;sulfuric acid.

Molecular Properties

Compound Namepotassium;sulfo sulfate;sulfuric acid
PubChem CID158562224
Molecular FormulaH3KO11S3
Molecular Weight314.31 g/mol
Exact Mass313.85
IUPAC Namepotassium;sulfo sulfate;sulfuric acid
SMILESO=S(=O)(O)O.O=S(=O)([O-])OS(=O)(=O)O.[K+]
InChIInChI=1S/K.H2O7S2.H2O4S/c;1-8(2,3)7-9(4,5)6;1-5(2,3)4/h;(H,1,2,3)(H,4,5,6);(H2,1,2,3,4)/q+1;;/p-1
InChIKeyHRAIBBFAAYBESA-UHFFFAOYSA-M
XLogP-5.38
TPSA195.40 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.31
LogP ≤ 5-5.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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

potassium sulfo sulfate
CID 157130711
sodium sulfooxysulfonyl sulfate
CID 175371917
dipotassium;sulfonatooxy sulfate;sulfuric acid
CID 91756367
CID 173332753
CID 173332753
magnesium;dipotassium;sulfuric acid;disulfate
CID 57348205
platinum(4+);sulfonato sulfate
CID 57353350
silane;sulfo hydrogen sulfate
CID 173332743
sulfonato sulfate;bis(tetramethylphosphanium)
CID 174869555
lithium;silver;sulfuric acid;sulfate
CID 158234411
aluminum;sodium;sulfonato sulfate
CID 159964180
CID 158094852
CID 158094852
potassium hydroxy sulfate
CID 23712892

Frequently Asked Questions

What is the IUPAC name of potassium;sulfo sulfate;sulfuric acid?
The IUPAC name of potassium;sulfo sulfate;sulfuric acid (CID 158562224) is potassium;sulfo sulfate;sulfuric acid.
What is the SMILES notation for potassium;sulfo sulfate;sulfuric acid?
The canonical SMILES for potassium;sulfo sulfate;sulfuric acid is O=S(=O)(O)O.O=S(=O)([O-])OS(=O)(=O)O.[K+].
What is the InChIKey of potassium;sulfo sulfate;sulfuric acid?
The InChIKey is HRAIBBFAAYBESA-UHFFFAOYSA-M. The full InChI is InChI=1S/K.H2O7S2.H2O4S/c;1-8(2,3)7-9(4,5)6;1-5(2,3)4/h;(H,1,2,3)(H,4,5,6);(H2,1,2,3,4)/q+1;;/p-1.
What are the key properties of potassium;sulfo sulfate;sulfuric acid?
potassium;sulfo sulfate;sulfuric acid has a molecular weight of 314.31 g/mol, XLogP of -5.38, 2 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;sulfo sulfate;sulfuric acid is sourced from PubChem (CID 158562224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).