Triphenylvinylphosphonium bromide

C20H18BrPCAS 5044-52-0369.24 g/mol

Open in Covalent MOL file
P+Br−
Alkene

Properties

Molecular formula
C20H18BrP
Molar mass
369.24 g/mol
Exact mass
368.0330 Da
logP
1.13Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
5044-52-0
SMILES
C=C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
InChIKey
VRAYVWUMBAJVGH-UHFFFAOYSA-M
InChI
InChI=1S/C20H18P.BrH/c1-2-21(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;/h2-17H,1H2;1H/q+1;/p-1

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Names and synonyms

7 names
  • Phosphonium, ethenyltriphenyl-, bromide (1:1)
  • Phosphonium, triphenylvinyl-, bromide
  • Phosphonium, ethenyltriphenyl-, bromide
  • Vinyltriphenylphosphonium bromide
  • NSC 84065
  • Bromotriphenylvinylphosphorane
  • Vinyl(triphenyl)phosphine bromide

Work with Triphenylvinylphosphonium 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

Allyltriphenylphosphonium bromide1560-54-950 % similar Tetraphenylphosphonium bromide2751-90-850 % similar (4-Pentenyl)triphenylphosphonium bromide56771-29-048 % similar Ethane-1,2-diylbis(triphenylphosphonium) bromide1519-45-544 % similar Methyltriphenylphosphonium bromide1779-49-344 % similar Tetramethylenebis[triphenylphosphonium] dibromide15546-42-641 % similar Bromomethyltriphenylphosphonium bromide1034-49-740 % similar Cyclopropyltriphenylphosphonium bromide14114-05-740 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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