chempirical

Benzo[B]triphenylene

C22H14CAS 215-58-7278.35 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C22H14
Molar mass
278.35 g/mol
Exact mass
278.1096 Da
Melting point
206 °C
Boiling point
524 °C
logP
6.30Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
215-58-7
SMILES
c1ccc2cc3c4ccccc4c4ccccc4c3cc2c1
InChIKey
RAASUWZPTOJQAY-UHFFFAOYSA-N
InChI
InChI=1S/C22H14/c1-2-8-16-14-22-20-12-6-4-10-18(20)17-9-3-5-11-19(17)21(22)13-15(16)7-1/h1-14H

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

Names and synonyms

5 names
  • 1,2:3,4-Dibenzanthracene
  • Dibenz[a,c]anthracene
  • Dibenzo[a,c]anthracene
  • 1,2:3,4-Dibenzoanthracene
  • 2,3-Benzotriphenylene

Work with Benzo[B]triphenylene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Anthracene120-12-760 % similar Benz(A)anthracene56-55-360 % similar Triphenylene217-59-457 % similar Tetracene92-24-056 % similar Chrysene218-01-956 % similar Phenanthrene85-01-853 % similar 9,9′-Bianthryl1055-23-853 % similar Benzo(E)pyrene192-97-250 % similar

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

Same formula

Pentacene135-48-8 1,4-Bis(2-phenylethynyl)benzene1849-27-0 Dibenz(A,H)anthracene53-70-3

Elsewhere

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