chempirical

Sodiumtetrakis(pentafluorophenyl)borate

C24BF20NaCAS 149213-65-0702.03 g/mol

Open in Covalent MOL file
B−FFFFFFFFFFFFFFFFFFFFNa+
Aryl halide

Properties

Molecular formula
C24BF20Na
Molar mass
702.03 g/mol
Exact mass
701.9671 Da
logP
2.85Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
149213-65-0
SMILES
[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)(C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.[Na+]
InChIKey
NXSPYLCTDFECPN-UHFFFAOYSA-N
InChI
InChI=1S/C24BF20.Na/c26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33;/q-1;+1

Weigh it out

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

Names and synonyms

1 names
  • Sodium tetrakis pentafluorophenyl borate

Work with Sodiumtetrakis(pentafluorophenyl)borate

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(4-Isopropylphenyl)(4-methylphenyl)iodonium tetrakis(pentafluorophenyl)borate178233-72-2Salt Triphenylcarbenium tetrakis(pentafluorophenyl)borate136040-19-2Salt Dimethylanilinium tetrakis(pentafluorophenyl)borate118612-00-3Salt

Similar compounds

Hexafluorobenzene392-56-340 % similar Octafluoronaphthalene313-72-433 % similar Decafluorobiphenyl434-90-233 % similar Sodium tetrakis(4-fluorophenyl)borate25776-12-932 % similar Bromopentafluorobenzene344-04-730 % similar 1,2-Dibromotetrafluorobenzene827-08-730 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook