potassium;hydride;sulfooxy hydrogen sulfate

H3KO8S2 — CID 175284935

IUPACpotassium;hydride;sulfooxy hydrogen sulfate
SMILESO=S(=O)(O)OOS(=O)(=O)O.[H-].[K+]
InChIInChI=1S/K.H2O8S2.H/c;1-9(2,3)7-8-10(4,5)6;/h;(H,1,2,3)(H,4,5,6);/q+1;;-1
InChIKeyZEVXPQSPLNAWFB-UHFFFAOYSA-N
MW234.25 g/mol
LogP-4.34
Rot. Bonds3

About potassium;hydride;sulfooxy hydrogen sulfate

potassium;hydride;sulfooxy hydrogen sulfate (PubChem CID 175284935) has the molecular formula H3KO8S2 and a molecular weight of 234.25 g/mol. Its IUPAC name is potassium;hydride;sulfooxy hydrogen sulfate.

Molecular Properties

Compound Namepotassium;hydride;sulfooxy hydrogen sulfate
PubChem CID175284935
Molecular FormulaH3KO8S2
Molecular Weight234.25 g/mol
Exact Mass233.89
IUPAC Namepotassium;hydride;sulfooxy hydrogen sulfate
SMILESO=S(=O)(O)OOS(=O)(=O)O.[H-].[K+]
InChIInChI=1S/K.H2O8S2.H/c;1-9(2,3)7-8-10(4,5)6;/h;(H,1,2,3)(H,4,5,6);/q+1;;-1
InChIKeyZEVXPQSPLNAWFB-UHFFFAOYSA-N
XLogP-4.34
TPSA127.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 5-4.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium;hydride;sulfooxy hydrogen sulfate?
The IUPAC name of potassium;hydride;sulfooxy hydrogen sulfate (CID 175284935) is potassium;hydride;sulfooxy hydrogen sulfate.
What is the SMILES notation for potassium;hydride;sulfooxy hydrogen sulfate?
The canonical SMILES for potassium;hydride;sulfooxy hydrogen sulfate is O=S(=O)(O)OOS(=O)(=O)O.[H-].[K+].
What is the InChIKey of potassium;hydride;sulfooxy hydrogen sulfate?
The InChIKey is ZEVXPQSPLNAWFB-UHFFFAOYSA-N. The full InChI is InChI=1S/K.H2O8S2.H/c;1-9(2,3)7-8-10(4,5)6;/h;(H,1,2,3)(H,4,5,6);/q+1;;-1.
What are the key properties of potassium;hydride;sulfooxy hydrogen sulfate?
potassium;hydride;sulfooxy hydrogen sulfate has a molecular weight of 234.25 g/mol, XLogP of -4.34, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;sulfooxy hydrogen sulfate is sourced from PubChem (CID 175284935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).