1,3,5-Tris(3-bromophenyl)benzene

C₂₄H₁₅Br₃CAS 96761-85-2543.10 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₄H₁₅Br₃
Molar mass: 543.10 g/mol
Exact mass: 539.8724 Da
logP: 8.98Crippen estimate
Polar surface area: 0.0 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

96761-85-2

SMILES

C1=CC(=CC(=C1)Br)C2=CC(=CC(=C2)C3=CC(=CC=C3)Br)C4=CC(=CC=C4)Br

InChIKey

JKCQADHKVQXKFF-UHFFFAOYSA-N

InChI

InChI=1S/C24H15Br3/c25-22-7-1-4-16(13-22)19-10-20(17-5-2-8-23(26)14-17)12-21(11-19)18-6-3-9-24(27)15-18/h1-15H

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Work with 1,3,5-Tris(3-bromophenyl)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

3,3''-Dibromo-1,1':3',1''-terphenyl95962-62-294 % similar 3-Bromobiphenyl2113-57-776 % similar 1-Bromo-3-(4-phenylphenyl)benzene1762-87-473 % similar 3-Bromo-3′-chloro-1,1′-biphenyl844856-42-467 % similar 3-Bromo-4'-chloro-1,1'-biphenyl164334-69-464 % similar 1-Bromo-3,5-diphenylbenzene103068-20-864 % similar 1,3-Dibromobenzene108-36-163 % similar 2-(3'-Bromo-[1,1'-biphenyl]-3-yl)-4,6-diphenyl-1,3,5-triazine1606981-69-463 % similar

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

Same formula

1,3,5-Tris(4-bromophenyl)benzene7511-49-1

Elsewhere

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