dipotassium;sulfonatooxy sulfate

K2O8S2 — CID 516926

IUPACdipotassium;sulfonatooxy sulfate
SMILESO=S(=O)([O-])OOS(=O)(=O)[O-].[K+].[K+]
InChIInChI=1S/2K.H2O8S2/c;;1-9(2,3)7-8-10(4,5)6/h;;(H,1,2,3)(H,4,5,6)/q2*+1;/p-2
InChIKeyUSHAGKDGDHPEEY-UHFFFAOYSA-L
MW270.32 g/mol
LogP-8.14
Rot. Bonds3

About dipotassium;sulfonatooxy sulfate

dipotassium;sulfonatooxy sulfate (PubChem CID 516926) has the molecular formula K2O8S2 and a molecular weight of 270.32 g/mol. Its IUPAC name is dipotassium;sulfonatooxy sulfate.

Molecular Properties

Compound Namedipotassium;sulfonatooxy sulfate
PubChem CID516926
Molecular FormulaK2O8S2
Molecular Weight270.32 g/mol
Exact Mass269.83
IUPAC Namedipotassium;sulfonatooxy sulfate
SMILESO=S(=O)([O-])OOS(=O)(=O)[O-].[K+].[K+]
InChIInChI=1S/2K.H2O8S2/c;;1-9(2,3)7-8-10(4,5)6/h;;(H,1,2,3)(H,4,5,6)/q2*+1;/p-2
InChIKeyUSHAGKDGDHPEEY-UHFFFAOYSA-L
XLogP-8.14
TPSA132.86 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 5-8.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

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Related Compounds

lithium;potassium;sulfonatooxy sulfate
CID 175555490
bis(rubidium(1+));sulfonatooxy sulfate
CID 18406061
strontium sulfonatooxy sulfate
CID 21114005
dicalcium sulfonatooxy sulfate
CID 159780487
dipotassium;sulfonatooxy sulfate;sulfuric acid
CID 91756367
disodium;azane;sulfonatooxy sulfate
CID 174725660
diazanium;sulfonatooxy sulfate;bis(sulfur dioxide)
CID 19430598
potassium;sodium;permanganic acid;sulfonatooxy sulfate
CID 175104604
dipotassium;2,3-dimethylbutane-2,3-diamine;sulfonatooxy sulfate
CID 173436078
disodium;sulfonatooxy sulfate;sulfurous acid
CID 22019774
oxidooxy sulfate
CID 135037388
iron(2+);sulfonatooxy sulfate;sulfuric acid;sulfurous acid
CID 173385794

Frequently Asked Questions

What is the IUPAC name of dipotassium;sulfonatooxy sulfate?
The IUPAC name of dipotassium;sulfonatooxy sulfate (CID 516926) is dipotassium;sulfonatooxy sulfate.
What is the SMILES notation for dipotassium;sulfonatooxy sulfate?
The canonical SMILES for dipotassium;sulfonatooxy sulfate is O=S(=O)([O-])OOS(=O)(=O)[O-].[K+].[K+].
What is the InChIKey of dipotassium;sulfonatooxy sulfate?
The InChIKey is USHAGKDGDHPEEY-UHFFFAOYSA-L. The full InChI is InChI=1S/2K.H2O8S2/c;;1-9(2,3)7-8-10(4,5)6/h;;(H,1,2,3)(H,4,5,6)/q2*+1;/p-2.
What are the key properties of dipotassium;sulfonatooxy sulfate?
dipotassium;sulfonatooxy sulfate has a molecular weight of 270.32 g/mol, XLogP of -8.14, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;sulfonatooxy sulfate is sourced from PubChem (CID 516926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).