potassium 2-fluorobutanoate

C4H6FKO2 — CID 168947698

IUPACpotassium 2-fluorobutanoate
SMILESCCC(F)C(=O)[O-].[K+]
InChIInChI=1S/C4H7FO2.K/c1-2-3(5)4(6)7;/h3H,2H2,1H3,(H,6,7);/q;+1/p-1
InChIKeyZAWROGVNVJQOOZ-UHFFFAOYSA-M
MW144.19 g/mol
LogP-3.51
Rot. Bonds2

About potassium 2-fluorobutanoate

potassium 2-fluorobutanoate (PubChem CID 168947698) has the molecular formula C4H6FKO2 and a molecular weight of 144.19 g/mol. Its IUPAC name is potassium 2-fluorobutanoate.

Molecular Properties

Compound Namepotassium 2-fluorobutanoate
PubChem CID168947698
Molecular FormulaC4H6FKO2
Molecular Weight144.19 g/mol
Exact Mass144.00
IUPAC Namepotassium 2-fluorobutanoate
SMILESCCC(F)C(=O)[O-].[K+]
InChIInChI=1S/C4H7FO2.K/c1-2-3(5)4(6)7;/h3H,2H2,1H3,(H,6,7);/q;+1/p-1
InChIKeyZAWROGVNVJQOOZ-UHFFFAOYSA-M
XLogP-3.51
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 5-3.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

silver 2-fluorobutanoate
CID 175008636
dipotassium;2,3-diethylbutanedioate
CID 88780134
2-fluoro-N,N-dimethylbutanamide
CID 14592376
dialuminum;tris(2-ethylpropanedioate)
CID 157429593
lithium 2-ethylbutanoate
CID 23681528
magnesium 2-ethylpropanedioate
CID 22261989
2-methylbutanoate
CID 91073357
tris(2-ethylbutanoate);niobium(3+)
CID 173096666
dipotassium;2-ethylbutanedioate
CID 172823194
magnesium bis(2-methylbutanoate)
CID 88739715
cobalt(2+);bis((2R)-2-methylbutanoate)
CID 90199434
bis(2-methylbutanoate);niobium(2+)
CID 18939928

Frequently Asked Questions

What is the IUPAC name of potassium 2-fluorobutanoate?
The IUPAC name of potassium 2-fluorobutanoate (CID 168947698) is potassium 2-fluorobutanoate.
What is the SMILES notation for potassium 2-fluorobutanoate?
The canonical SMILES for potassium 2-fluorobutanoate is CCC(F)C(=O)[O-].[K+].
What is the InChIKey of potassium 2-fluorobutanoate?
The InChIKey is ZAWROGVNVJQOOZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H7FO2.K/c1-2-3(5)4(6)7;/h3H,2H2,1H3,(H,6,7);/q;+1/p-1.
What are the key properties of potassium 2-fluorobutanoate?
potassium 2-fluorobutanoate has a molecular weight of 144.19 g/mol, XLogP of -3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-fluorobutanoate is sourced from PubChem (CID 168947698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).