1,3,5-Tri(9-carbazolyl)benzene

C₄₂H₂₇N₃CAS 148044-07-9573.70 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄₂H₂₇N₃
Molar mass: 573.70 g/mol
Exact mass: 573.2205 Da
logP: 10.98Crippen estimate
Polar surface area: 14.8 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

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

148044-07-9

SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC(=CC(=C4)N5C6=CC=CC=C6C7=CC=CC=C75)N8C9=CC=CC=C9C1=CC=CC=C18

InChIKey

DVNOWTJCOPZGQA-UHFFFAOYSA-N

InChI

InChI=1S/C42H27N3/c1-7-19-37-31(13-1)32-14-2-8-20-38(32)43(37)28-25-29(44-39-21-9-3-15-33(39)34-16-4-10-22-40(34)44)27-30(26-28)45-41-23-11-5-17-35(41)36-18-6-12-24-42(36)45/h1-27H

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Names and synonyms

1 names

9,9',9''-(Benzene-1,3,5-triyl)tri(9H-carbazole)

Work with 1,3,5-Tri(9-carbazolyl)benzene

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

9,9'-(1,3-Phenylene)bis-9H-carbazole550378-78-481 % similar 9,9'-(5-Bromo-1,3-phenylene)bis(9H-carbazole)750573-24-175 % similar 9-Phenylcarbazole1150-62-571 % similar 9-(3,5-Dibromophenyl)-9H-carbazole750573-26-368 % similar 4,4'-Bis(N-carbazolyl)-1,1'-biphenyl58328-31-765 % similar 9-(4-Phenylphenyl)carbazole6299-16-760 % similar 9-([1,1'-Biphenyl]-3-yl)-9H-carbazole1221237-87-159 % similar 4,4',4''-Tris(carbazol-9-yl)-triphenylamine139092-78-758 % similar

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

Elsewhere

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