chempirical

Tetrabutylammonium difluorotriphenylsilicate

C34H51F2NSiCAS 163931-61-1539.87 g/mol

Open in Covalent MOL file
N+Si−FF
Quaternary ammonium

Properties

Molecular formula
C34H51F2NSi
Molar mass
539.87 g/mol
Exact mass
539.3759 Da
logP
8.05Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
15

Identifiers

CAS number
163931-61-1
SMILES
CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)[Si-](C2=CC=CC=C2)(C3=CC=CC=C3)(F)F
InChIKey
RQBKGJOQACIQDG-UHFFFAOYSA-N
InChI
InChI=1S/C18H15F2Si.C16H36N/c19-21(20,16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h1-15H;5-16H2,1-4H3/q-1;+1

Weigh it out

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

Work with Tetrabutylammonium difluorotriphenylsilicate

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

Benzyltributylammonium chloride23616-79-749 % similar Benzyltributylammonium bromide25316-59-049 % similar Tetrabutylammonium hexafluorophosphate3109-63-542 % similar Tetrabutylammonium tetrafluoroborate429-42-542 % similar Tetrabutylammonium bromide1643-19-242 % similar Tetrabutylammonium hydroxide2052-49-542 % similar Tetra-N-butylammonium iodide311-28-442 % similar Tetrabutylammonium borohydride33725-74-542 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook