N-(4-Bromophenyl)-N-phenyl-1-naphthylamine

C₂₂H₁₆BrNCAS 138310-84-6374.28 g/mol

Open in Covalent MOL file

Aryl halide Tertiary amine

Properties

Molecular formula: C₂₂H₁₆BrN
Molar mass: 374.28 g/mol
Exact mass: 373.0466 Da
logP: 7.07Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

138310-84-6

SMILES

C1=CC=C(C=C1)N(C2=CC=C(C=C2)Br)C3=CC=CC4=CC=CC=C43

InChIKey

ABMCIJZTMPDEGW-UHFFFAOYSA-N

InChI

InChI=1S/C22H16BrN/c23-18-13-15-20(16-14-18)24(19-9-2-1-3-10-19)22-12-6-8-17-7-4-5-11-21(17)22/h1-16H

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Names and synonyms

1 names

N-(1-Naphthyl)-N-phenyl-4-bromoaniline

Work with N-(4-Bromophenyl)-N-phenyl-1-naphthylamine

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'-Bis- (1-naphthalenyl)-N,N'-bis-phenyl-(1,1'-biphenyl)-4,4'-diamine123847-85-872 % similar N,N'-Bis[4-(diphenylamino)phenyl]-N,N'-di(1-naphthyl)benzidine910058-11-670 % similar 4-Bromotriphenylamine36809-26-460 % similar 4,4'-Dibromotriphenylamine81090-53-160 % similar Spiro-NPB932739-76-955 % similar 4-Bromo-4'-(diphenylamino)biphenyl202831-65-055 % similar N-(4-Bromophenyl)-N-phenyl-[1,1'-biphenyl]-4-amine503299-24-953 % similar N-(4-Bromophenyl)-N,N-bis(1,1'-biphenyl-4-yl)amine499128-71-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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