chempirical

2-Chloro-N-[3-(trifluoromethyl)phenyl]acetamide

C9H7ClF3NOCAS 351-38-2237.61 g/mol

Open in Covalent MOL file
OClHNFFF
Alkyl halide

Properties

Molecular formula
C9H7ClF3NO
Molar mass
237.61 g/mol
Exact mass
237.0168 Da
Melting point
68 °C
logP
3.53Crippen estimate
Polar surface area
32.6 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
351-38-2
SMILES
OC(CCl)=Nc1cccc(C(F)(F)F)c1
InChIKey
MOEJRZLPQODXGM-UHFFFAOYSA-N
InChI
InChI=1S/C9H7ClF3NO/c10-5-8(15)14-7-3-1-2-6(4-7)9(11,12)13/h1-4H,5H2,(H,14,15)

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Names and synonyms

5 names
  • Acetamide, 2-chloro-N-[3-(trifluoromethyl)phenyl]-
  • m-Acetotoluidide, 2-chloro-α,α,α-trifluoro-
  • N-(3-Trifluoromethylphenyl)-2-chloroacetamide
  • 2-Chloro-m-trifluoromethylacetanilide
  • [(3-Trifluoromethylphenyl)aminocarbonylmethyl]chloride

Work with 2-Chloro-N-[3-(trifluoromethyl)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-[3-(Trifluoromethyl)phenyl]acetamide351-36-057 % similar Chloroacetanilide587-65-556 % similar 2-Methyl-N-[3-(trifluoromethyl)phenyl]propanamide1939-27-153 % similar Fluometuron2164-17-253 % similar 2-Chloro-N-(3,5-dichlorophenyl)acetamide33560-48-451 % similar 3-(Trifluoromethyl)phenyl isocyanate329-01-146 % similar 3-(Trifluoromethyl)benzyl chloride705-29-345 % similar 3,5-Bis(trifluoromethyl)benzene402-31-344 % similar

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

Elsewhere

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