N-(4-Bromophenyl)-N,N-bis(1,1'-biphenyl-4-yl)amine

C₃₀H₂₂BrNCAS 499128-71-1476.42 g/mol

Open in Covalent MOL file

Aryl halide Tertiary amine

Properties

Molecular formula: C₃₀H₂₂BrN
Molar mass: 476.42 g/mol
Exact mass: 475.0936 Da
logP: 9.25Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 5

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

499128-71-1

SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)N(C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=C(C=C5)Br

InChIKey

BTFIECQCKYNJTN-UHFFFAOYSA-N

InChI

InChI=1S/C30H22BrN/c31-27-15-21-30(22-16-27)32(28-17-11-25(12-18-28)23-7-3-1-4-8-23)29-19-13-26(14-20-29)24-9-5-2-6-10-24/h1-22H

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Names and synonyms

1 names

N-((1,1'-Biphenyl)-4-yl)-N-(4-bromophenyl)(1,1'-biphenyl)-4-amine

Work with N-(4-Bromophenyl)-N,N-bis(1,1'-biphenyl-4-yl)amine

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

N,N-Di((1,1'-biphenyl)-4-yl)-4'-bromo-(1,1'-biphenyl)-4-amine728039-63-2100 % similar 4,4'-Dibromo-4''-phenyltriphenylamine884530-69-2100 % similar N-(4-Bromophenyl)-N-phenyl-[1,1'-biphenyl]-4-amine503299-24-996 % similar 4-Bromo-4'-(diphenylamino)biphenyl202831-65-091 % similar 4-Bromotriphenylamine36809-26-478 % similar 4,4'-Dibromotriphenylamine81090-53-178 % similar [1,1'-Biphenyl]-4,4'-diamine, N4,N4,N4',N4'-tetrakis([1,1'-biphenyl]-4-yl)-164724-35-073 % similar 4-Bromo-P-terphenyl1762-84-173 % similar

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

Elsewhere

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