potassium;butane;trihydrofluoride

C4H12F3K — CID 175562651

IUPACpotassium;butane;trihydrofluoride
SMILESF.F.F.[CH2-]CCC.[K+]
InChIInChI=1S/C4H9.3FH.K/c1-3-4-2;;;;/h1,3-4H2,2H3;3*1H;/q-1;;;;+1
InChIKeyPCVZKZWTCSSIKB-UHFFFAOYSA-N
MW156.23 g/mol
LogP-0.92
Rot. Bonds1

About potassium;butane;trihydrofluoride

potassium;butane;trihydrofluoride (PubChem CID 175562651) has the molecular formula C4H12F3K and a molecular weight of 156.23 g/mol. Its IUPAC name is potassium;butane;trihydrofluoride.

Molecular Properties

Compound Namepotassium;butane;trihydrofluoride
PubChem CID175562651
Molecular FormulaC4H12F3K
Molecular Weight156.23 g/mol
Exact Mass156.05
IUPAC Namepotassium;butane;trihydrofluoride
SMILESF.F.F.[CH2-]CCC.[K+]
InChIInChI=1S/C4H9.3FH.K/c1-3-4-2;;;;/h1,3-4H2,2H3;3*1H;/q-1;;;;+1
InChIKeyPCVZKZWTCSSIKB-UHFFFAOYSA-N
XLogP-0.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium;butane;trihydrofluoride?
The IUPAC name of potassium;butane;trihydrofluoride (CID 175562651) is potassium;butane;trihydrofluoride.
What is the SMILES notation for potassium;butane;trihydrofluoride?
The canonical SMILES for potassium;butane;trihydrofluoride is F.F.F.[CH2-]CCC.[K+].
What is the InChIKey of potassium;butane;trihydrofluoride?
The InChIKey is PCVZKZWTCSSIKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9.3FH.K/c1-3-4-2;;;;/h1,3-4H2,2H3;3*1H;/q-1;;;;+1.
What are the key properties of potassium;butane;trihydrofluoride?
potassium;butane;trihydrofluoride has a molecular weight of 156.23 g/mol, XLogP of -0.92, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;butane;trihydrofluoride is sourced from PubChem (CID 175562651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).