N-(4-Bromo-3-methylphenyl)acetamide

C₉H₁₀BrNOCAS 90914-81-1228.09 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₀BrNO
Molar mass: 228.09 g/mol
Exact mass: 226.9946 Da
Melting point: 103–104 °C
logP: 3.37Crippen estimate
Polar surface area: 32.6 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

90914-81-1

SMILES

CC(O)=Nc1ccc(Br)c(C)c1

InChIKey

BYZHUFNLXFFINU-UHFFFAOYSA-N

InChI

InChI=1S/C9H10BrNO/c1-6-5-8(11-7(2)12)3-4-9(6)10/h3-5H,1-2H3,(H,11,12)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names

Acetamide, N-(4-bromo-3-methylphenyl)-
m-Acetotoluidide, 4′-bromo-
4′-Bromo-3′-methylacetanilide
3-Methyl-4-bromo-N-acetylaniline

Work with N-(4-Bromo-3-methylphenyl)acetamide

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-(3,4-Dimethylphenyl)acetamide2198-54-169 % similar N-[4-Bromo-3-(trifluoromethyl)phenyl]acetamide41513-05-759 % similar Bromoacetanilide103-88-855 % similar N,N′-Diacetyl-P-phenylenediamine140-50-153 % similar P-Acetotoluidide103-89-950 % similar N-(3-Methylphenyl)acetamide537-92-849 % similar 4-Acetamidothiophenol1126-81-449 % similar N-(2-Bromophenyl)acetamide614-76-647 % similar

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

Same formula

N-(4-Bromo-2-methylphenyl)acetamide24106-05-6 N-(2-Bromo-4-methylphenyl)acetamide614-83-5

Elsewhere

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