Tetraphenylphosphonium tetraphenylborate

C₄₈H₄₀BPCAS 15525-15-2658.63 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄₈H₄₀BP
Molar mass: 658.63 g/mol
Exact mass: 658.2961 Da
logP: 7.37Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 8

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

15525-15-2

SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChIKey

QYFWPOPFFBCTLK-UHFFFAOYSA-N

InChI

InChI=1S/C24H20B.C24H20P/c2*1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h2*1-20H/q-1;+1

Weigh it out

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

Work with Tetraphenylphosphonium tetraphenylborate

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.

Sodium tetraphenylborate143-66-8Salt Tetraphenylphosphonium chloride2001-45-8Salt Tetraphenylphosphonium bromide2751-90-8Salt Tetraphenylphosphonium iodide2065-67-0Salt Tetraphenylphosphonium phenoxide15464-47-8Salt

Similar compounds

Methyltriphenylphosphonium chloride1031-15-833 % similar Ethane-1,2-diylbis(triphenylphosphonium) bromide1519-45-533 % similar Potassium phenyltrifluoroborate153766-81-533 % similar Methyltriphenylphosphonium bromide1779-49-333 % similar Methyltriphenylphosphonium iodide2065-66-933 % similar Tetramethylenebis[triphenylphosphonium] dibromide15546-42-631 % similar Triphenylpropylphosphonium15912-75-131 % similar Bromomethyltriphenylphosphonium bromide1034-49-730 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook