butylphosphanium fluoride

C4H12FP — CID 122641370

IUPACbutylphosphanium fluoride
SMILESCCCC[PH3+].[F-]
InChIInChI=1S/C4H11P.FH/c1-2-3-4-5;/h2-5H2,1H3;1H
InChIKeyDZNMXEFGZXCYGH-UHFFFAOYSA-N
MW110.11 g/mol
LogP-1.60
Rot. Bonds2

About butylphosphanium fluoride

butylphosphanium fluoride (PubChem CID 122641370) has the molecular formula C4H12FP and a molecular weight of 110.11 g/mol. Its IUPAC name is butylphosphanium fluoride.

Molecular Properties

Compound Namebutylphosphanium fluoride
PubChem CID122641370
Molecular FormulaC4H12FP
Molecular Weight110.11 g/mol
Exact Mass110.07
IUPAC Namebutylphosphanium fluoride
SMILESCCCC[PH3+].[F-]
InChIInChI=1S/C4H11P.FH/c1-2-3-4-5;/h2-5H2,1H3;1H
InChIKeyDZNMXEFGZXCYGH-UHFFFAOYSA-N
XLogP-1.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.11
LogP ≤ 5-1.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

butylphosphanium;palladium
CID 173044196
octadecylphosphanium iodide
CID 21470281
CID 161246447
CID 161246447
azane;hexane
CID 18428977
hexane;tungsten
CID 162105258
hexane;molybdenum
CID 162092649
hexane;tetrahydrate
CID 174107213
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
decane;heptane
CID 159049036
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649

Frequently Asked Questions

What is the IUPAC name of butylphosphanium fluoride?
The IUPAC name of butylphosphanium fluoride (CID 122641370) is butylphosphanium fluoride.
What is the SMILES notation for butylphosphanium fluoride?
The canonical SMILES for butylphosphanium fluoride is CCCC[PH3+].[F-].
What is the InChIKey of butylphosphanium fluoride?
The InChIKey is DZNMXEFGZXCYGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11P.FH/c1-2-3-4-5;/h2-5H2,1H3;1H.
What are the key properties of butylphosphanium fluoride?
butylphosphanium fluoride has a molecular weight of 110.11 g/mol, XLogP of -1.60, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butylphosphanium fluoride is sourced from PubChem (CID 122641370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).