4-Bromo-2,6-diethylaniline

C₁₀H₁₄BrNCAS 56746-19-1228.13 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₁₀H₁₄BrN
Molar mass: 228.13 g/mol
Exact mass: 227.0310 Da
logP: 3.16Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

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

56746-19-1

SMILES

CCC1=CC(=CC(=C1N)CC)Br

InChIKey

BEJYDMQQZUACPW-UHFFFAOYSA-N

InChI

InChI=1S/C10H14BrN/c1-3-7-5-9(11)6-8(4-2)10(7)12/h5-6H,3-4,12H2,1-2H3

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Work with 4-Bromo-2,6-diethylaniline

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

4,4′-Methylenebis[2,6-diethylaniline]13680-35-859 % similar 2,6-Diethyl-4-methylbenzenamine24544-08-959 % similar 4-Bromo-2-ethylaniline45762-41-257 % similar 2,6-Diethylaniline579-66-854 % similar 4-Bromo-2-ethyl-1-iodobenzene175278-30-547 % similar 4-Bromo-2,6-dimethylbenzenamine24596-19-846 % similar 4,4'-Methylenebis(2-ethyl-6-methylaniline)19900-72-245 % similar 2-Amino-3,5-dibromobenzenemethanol50739-76-945 % similar

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

Same formula

2-Bromo-4-(tert-butyl)aniline103273-01-4 4-Bromo-N,N-diethylbenzenamine2052-06-4

Elsewhere

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