Tetraphenyl butadiene

C28H22CAS 1450-63-1358.48 g/mol

Open in Covalent MOL file
Alkene

Properties

Molecular formula
C28H22
Molar mass
358.48 g/mol
Exact mass
358.1722 Da
Melting point
200 °C
logP
7.25Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
5

Hazards

Warning
Irritant (GHS07)

Aggregated from 47 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
1450-63-1
SMILES
C(C=C(c1ccccc1)c1ccccc1)=C(c1ccccc1)c1ccccc1
InChIKey
KLCLIOISYBHYDZ-UHFFFAOYSA-N
InChI
InChI=1S/C28H22/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-22H

Weigh it out

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

Names and synonyms

12 names
  • 1,1,4,4-Tetraphenylbutadiene
  • Benzene, 1,1′,1′′,1′′′-(1,3-butadiene-1,4-diylidene)tetrakis-
  • 1,3-Butadiene, 1,1,4,4-tetraphenyl-
  • 1,1′,1′′,1′′′-(1,3-Butadiene-1,4-diylidene)tetrakis[benzene]
  • 1,1,4,4-Tetraphenyl-1,3-butadiene
  • Tetraphenylbutadiene
  • TPB (dopant)
  • TPB
  • NSC 12572
  • 1,1′,4,4′-Tetraphenyl-1,3-butadiene
  • 1,1′,1′′,1′′′-Buta-1,3-diene-1,1,4,4-tetrayltetrabenzene
  • Benzene, 1,1',1'',1'''-(1,3-butadiene-1,4-diylidene)tetrakis-

Work with Tetraphenyl butadiene

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

Triphenylethylene58-72-057 % similar 4,4'-Bis(2,2-diphenylvinyl)-1,1'-biphenyl142289-08-550 % similar Tetraphenylethylene632-51-950 % similar 2-(4-Bromophenyl)-1,1-diphenylethylene18648-66-344 % similar 1,4-Diphenyl-2-butene-1,4-dione4070-75-143 % similar trans-1,2-Dibenzoylethylene959-28-443 % similar Benzophenone imine1013-88-343 % similar Benzophenone119-61-943 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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