Ethylenebis[triphenylphosphonium bromide]

C₃₈H₃₄Br₂P₂CAS 1519-45-5712.45 g/mol

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Properties

Molecular formula: C₃₈H₃₄Br₂P₂
Molar mass: 712.45 g/mol
Exact mass: 710.0503 Da
Melting point: 308–315 °C
logP: 0.98Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 9

Identifiers

CAS number

1519-45-5

SMILES

[Br-].[Br-].c1ccc([P+](CC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1

InChIKey

VRKRIHCAYUNAPF-UHFFFAOYSA-L

InChI

InChI=1S/C38H34P2.2BrH/c1-7-19-33(20-8-1)39(34-21-9-2-10-22-34,35-23-11-3-12-24-35)31-32-40(36-25-13-4-14-26-36,37-27-15-5-16-28-37)38-29-17-6-18-30-38;;/h1-30H,31-32H2;2*1H/q+2;;/p-2

Weigh it out

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

Names and synonyms

6 names

Phosphonium, 1,1′-(1,2-ethanediyl)bis[1,1,1-triphenyl-, bromide (1:2)
Phosphonium, ethylenebis[triphenyl-, dibromide
Phosphonium, 1,2-ethanediylbis[triphenyl-, dibromide
Dimethylenebistriphenylphosphonium bromide
1,2-Ethanediylbis(triphenylphosphonium) dibromide
NSC 64111

Work with Ethylenebis[triphenylphosphonium bromide]

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

Tetramethylenebis[triphenylphosphonium] dibromide15546-42-681 % similar Propyltriphenylphosphonium bromide6228-47-371 % similar Triphenyl(3-phenylpropyl)phosphonium bromide7484-37-971 % similar Butyltriphenylphosphonium bromide1779-51-765 % similar (3-Bromopropyl)triphenylphosphonium bromide3607-17-865 % similar [2-(Dimethylamino)ethyl]triphenylphosphonium bromide21331-80-663 % similar Pentyltriphenylphosphonium bromide21406-61-163 % similar Isopentyltriphenylphosphonium bromide28322-40-963 % similar

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

Elsewhere

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