potassium decanoate

C10H19KO2 — CID 23688501

IUPACpotassium decanoate
SMILESCCCCCCCCCC(=O)[O-].[K+]
InChIInChI=1S/C10H20O2.K/c1-2-3-4-5-6-7-8-9-10(11)12;/h2-9H2,1H3,(H,11,12);/q;+1/p-1
InChIKeyQDIGBJJRWUZARS-UHFFFAOYSA-M
MW210.36 g/mol
LogP-1.12
Rot. Bonds8

About potassium decanoate

potassium decanoate (PubChem CID 23688501) has the molecular formula C10H19KO2 and a molecular weight of 210.36 g/mol. Its IUPAC name is potassium decanoate.

Molecular Properties

Compound Namepotassium decanoate
PubChem CID23688501
Molecular FormulaC10H19KO2
Molecular Weight210.36 g/mol
Exact Mass210.10
IUPAC Namepotassium decanoate
SMILESCCCCCCCCCC(=O)[O-].[K+]
InChIInChI=1S/C10H20O2.K/c1-2-3-4-5-6-7-8-9-10(11)12;/h2-9H2,1H3,(H,11,12);/q;+1/p-1
InChIKeyQDIGBJJRWUZARS-UHFFFAOYSA-M
XLogP-1.12
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 5-1.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

potassium heptanoate
CID 23681741
tripotassium;dodecanoate;hexadecanoate;tetradecanoate
CID 161147915
potassium heptadecanoate
CID 23668524
potassium pentadecanoate
CID 23696764
octapotassium;octakis(decanoate)
CID 23617120
potassium;sodium;bis(tetradecanoate)
CID 158769581
CID 23623890
CID 23623890
octadecanoate
CID 3033836
bis(octadecanoate);platinum(2+)
CID 87233709
aluminum tris(dodecanoate)
CID 18764696
docosanoate;platinum(4+)
CID 173129133
barium(2+);bis(icosanoate)
CID 6451429

Frequently Asked Questions

What is the IUPAC name of potassium decanoate?
The IUPAC name of potassium decanoate (CID 23688501) is potassium decanoate.
What is the SMILES notation for potassium decanoate?
The canonical SMILES for potassium decanoate is CCCCCCCCCC(=O)[O-].[K+].
What is the InChIKey of potassium decanoate?
The InChIKey is QDIGBJJRWUZARS-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H20O2.K/c1-2-3-4-5-6-7-8-9-10(11)12;/h2-9H2,1H3,(H,11,12);/q;+1/p-1.
What are the key properties of potassium decanoate?
potassium decanoate has a molecular weight of 210.36 g/mol, XLogP of -1.12, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium decanoate is sourced from PubChem (CID 23688501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).