chempirical

Tetrabutylammonium hexafluorophosphate

C16H36F6NPCAS 3109-63-5387.44 g/mol

Open in Covalent MOL file
N+FP−FFFFF
Quaternary ammonium

Properties

Molecular formula
C16H36F6NP
Molar mass
387.44 g/mol
Exact mass
387.2490 Da
Melting point
243–246 °C
logP
8.39Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
12

Identifiers

CAS number
3109-63-5
SMILES
CCCC[N+](CCCC)(CCCC)CCCC.F[P-](F)(F)(F)(F)F
InChIKey
BKBKEFQIOUYLBC-UHFFFAOYSA-N
InChI
InChI=1S/C16H36N.F6P/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-7(2,3,4,5)6/h5-16H2,1-4H3;/q+1;-1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • 1-Butanaminium, N,N,N-tributyl-, hexafluorophosphate(1-) (1:1)
  • Ammonium, tetrabutyl-, hexafluorophosphate(1-)
  • 1-Butanaminium, N,N,N-tributyl-, hexafluorophosphate(1-)
  • Phosphate(1-), hexafluoro-, tetrabutylammonium
  • Phosphate(1-), hexafluoro-, N,N,N-tributyl-1-butanaminium
  • Tetra-n-butylammonium hexafluorophosphate
  • Tetrabutylammonium hexafluorophosphate(1-)
  • Tetra-n-butylammonium hexaflurophosphate
  • TBAPF6

Work with Tetrabutylammonium hexafluorophosphate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Tetrabutylammonium chloride1112-67-059 % similar Tetrabutylammonium bromide1643-19-259 % similar Tetrabutylammonium hydroxide2052-49-559 % similar Tetra-N-butylammonium iodide311-28-459 % similar Tetrabutylammonium borohydride33725-74-559 % similar Tetra-N-butylammonium fluoride429-41-459 % similar Tetrabutylammonium tetrafluoroborate429-42-558 % similar Tetrabutylammonium perchlorate1923-70-252 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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