potassium;sodium;diacetate

C4H6KNaO4 — CID 21470705

IUPACpotassium;sodium;diacetate
SMILESCC(=O)[O-].CC(=O)[O-].[K+].[Na+]
InChIInChI=1S/2C2H4O2.K.Na/c2*1-2(3)4;;/h2*1H3,(H,3,4);;/q;;2*+1/p-2
InChIKeyPSBAZVJEUNOIDU-UHFFFAOYSA-L
MW180.18 g/mol
LogP-8.48
Rot. Bonds

About potassium;sodium;diacetate

potassium;sodium;diacetate (PubChem CID 21470705) has the molecular formula C4H6KNaO4 and a molecular weight of 180.18 g/mol. Its IUPAC name is potassium;sodium;diacetate.

Molecular Properties

Compound Namepotassium;sodium;diacetate
PubChem CID21470705
Molecular FormulaC4H6KNaO4
Molecular Weight180.18 g/mol
Exact Mass179.98
IUPAC Namepotassium;sodium;diacetate
SMILESCC(=O)[O-].CC(=O)[O-].[K+].[Na+]
InChIInChI=1S/2C2H4O2.K.Na/c2*1-2(3)4;;/h2*1H3,(H,3,4);;/q;;2*+1/p-2
InChIKeyPSBAZVJEUNOIDU-UHFFFAOYSA-L
XLogP-8.48
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.18
LogP ≤ 5-8.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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trisodium;acetate;carbonate
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potassium;methanol;acetate
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disodium;sulfanide;acetate
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tetrasodium;tetraacetate;hydrate
CID 141360802
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tetrasodium;acetic acid;tetraacetate
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pentasodium;ethene;pentaacetate
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Frequently Asked Questions

What is the IUPAC name of potassium;sodium;diacetate?
The IUPAC name of potassium;sodium;diacetate (CID 21470705) is potassium;sodium;diacetate.
What is the SMILES notation for potassium;sodium;diacetate?
The canonical SMILES for potassium;sodium;diacetate is CC(=O)[O-].CC(=O)[O-].[K+].[Na+].
What is the InChIKey of potassium;sodium;diacetate?
The InChIKey is PSBAZVJEUNOIDU-UHFFFAOYSA-L. The full InChI is InChI=1S/2C2H4O2.K.Na/c2*1-2(3)4;;/h2*1H3,(H,3,4);;/q;;2*+1/p-2.
What are the key properties of potassium;sodium;diacetate?
potassium;sodium;diacetate has a molecular weight of 180.18 g/mol, XLogP of -8.48, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;sodium;diacetate is sourced from PubChem (CID 21470705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).