potassium butanoate

C4H7KO2 — CID 23677461

IUPACpotassium butanoate
SMILESCCCC(=O)[O-].[K+]
InChIInChI=1S/C4H8O2.K/c1-2-3-4(5)6;/h2-3H2,1H3,(H,5,6);/q;+1/p-1
InChIKeyRWMKSKOZLCXHOK-UHFFFAOYSA-M
MW126.20 g/mol
LogP-3.46
Rot. Bonds2

About potassium butanoate

potassium butanoate (PubChem CID 23677461) has the molecular formula C4H7KO2 and a molecular weight of 126.20 g/mol. Its IUPAC name is potassium butanoate.

Molecular Properties

Compound Namepotassium butanoate
PubChem CID23677461
Molecular FormulaC4H7KO2
Molecular Weight126.20 g/mol
Exact Mass126.01
IUPAC Namepotassium butanoate
SMILESCCCC(=O)[O-].[K+]
InChIInChI=1S/C4H8O2.K/c1-2-3-4(5)6;/h2-3H2,1H3,(H,5,6);/q;+1/p-1
InChIKeyRWMKSKOZLCXHOK-UHFFFAOYSA-M
XLogP-3.46
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 5-3.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

tetrapotassium;butanoate
CID 140982885
silver butanoate
CID 14944495
butanoate;ytterbium(2+)
CID 88777454
strontium butanoate
CID 19035288
butanoate;bis(rhodium(3+))
CID 173415846
butanoate;tin(4+)
CID 159447903
magnesium butanoate
CID 6453218
disodium;butanoate;hydroxide
CID 173219323
butanoate;silicon(4+);titanium(4+)
CID 158800899
butanoate;carbanide;chromium(3+)
CID 158360920
butanoate;titanium(4+);acetate
CID 159866524
butanoate;titanium(2+);acetate
CID 87845450

Frequently Asked Questions

What is the IUPAC name of potassium butanoate?
The IUPAC name of potassium butanoate (CID 23677461) is potassium butanoate.
What is the SMILES notation for potassium butanoate?
The canonical SMILES for potassium butanoate is CCCC(=O)[O-].[K+].
What is the InChIKey of potassium butanoate?
The InChIKey is RWMKSKOZLCXHOK-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H8O2.K/c1-2-3-4(5)6;/h2-3H2,1H3,(H,5,6);/q;+1/p-1.
What are the key properties of potassium butanoate?
potassium butanoate has a molecular weight of 126.20 g/mol, XLogP of -3.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium butanoate is sourced from PubChem (CID 23677461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).