N-[4-Bromo-2-(trifluoromethoxy)phenyl]acetamide

C₉H₇BrF₃NO₂CAS 175278-18-9298.06 g/mol

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Alkyl halide Aryl halide Ether

Properties

Molecular formula: C₉H₇BrF₃NO₂
Molar mass: 298.06 g/mol
Exact mass: 296.9612 Da
logP: 3.96Crippen estimate
Polar surface area: 41.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Identifiers

CAS number

175278-18-9

SMILES

CC(O)=Nc1ccc(Br)cc1OC(F)(F)F

InChIKey

SHHWWZMWTUTJPY-UHFFFAOYSA-N

InChI

InChI=1S/C9H7BrF3NO2/c1-5(15)14-7-3-2-6(10)4-8(7)16-9(11,12)13/h2-4H,1H3,(H,14,15)

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Names and synonyms

1 names

Acetamide, N-[4-bromo-2-(trifluoromethoxy)phenyl]-

Work with N-[4-Bromo-2-(trifluoromethoxy)phenyl]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-(4-Bromo-2-fluorophenyl)acetamide326-66-957 % similar N-(4-Bromo-2-methylphenyl)acetamide24106-05-655 % similar 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene105529-58-648 % similar Bromoacetanilide103-88-845 % similar N-(2-Bromo-4-fluorophenyl)acetamide1009-22-943 % similar 1-Bromo-4-(trifluoromethoxy)benzene407-14-743 % similar N-(2-Bromo-4-methylphenyl)acetamide614-83-541 % similar N-[4-Iodo-2-(trifluoromethyl)phenyl]acetamide97760-98-041 % similar

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

Elsewhere

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