3-Bromo-biphenyl-4-ylamine

C₁₂H₁₀BrNCAS 41738-70-9248.12 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₁₂H₁₀BrN
Molar mass: 248.12 g/mol
Exact mass: 246.9997 Da
logP: 3.70Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

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

41738-70-9

SMILES

C1=CC=C(C=C1)C2=CC(=C(C=C2)N)Br

InChIKey

NUMYOKLDZQAXAJ-UHFFFAOYSA-N

InChI

InChI=1S/C12H10BrN/c13-11-8-10(6-7-12(11)14)9-4-2-1-3-5-9/h1-8H,14H2

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Names and synonyms

1 names

2-Bromo-4-phenylaniline

Work with 3-Bromo-biphenyl-4-ylamine

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

2-Bromoaniline615-36-154 % similar 2,4-Dibromoaniline615-57-652 % similar 2-Amino-4-phenylphenol1134-36-750 % similar 4-Amino-3-bromobenzonitrile50397-74-548 % similar 2-Bromo-4-fluoroaniline1003-98-148 % similar 2-Bromo-4-methylaniline583-68-648 % similar 2-Bromo-4-chloroaniline873-38-148 % similar 2''-Bromo-[1,1';4',1'']terphenyl3282-24-448 % similar

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

Same formula

4-Bromodiphenylamine54446-36-5 2-Bromo-N-phenylaniline61613-22-7

Elsewhere

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