chempirical

N-[4-(Trifluoromethyl)phenyl]acetamide

C9H8F3NOCAS 349-97-3203.16 g/mol

Open in Covalent MOL file
OHNFFF
Alkyl halide

Properties

Molecular formula
C9H8F3NO
Molar mass
203.16 g/mol
Exact mass
203.0558 Da
Melting point
104–105 °C
logP
3.31Crippen estimate
Polar surface area
32.6 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
349-97-3
SMILES
CC(O)=Nc1ccc(C(F)(F)F)cc1
InChIKey
DFDHFECLWHHELH-UHFFFAOYSA-N
InChI
InChI=1S/C9H8F3NO/c1-6(14)13-8-4-2-7(3-5-8)9(10,11)12/h2-5H,1H3,(H,13,14)

Weigh it out

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Names and synonyms

7 names
  • Acetamide, N-[4-(trifluoromethyl)phenyl]-
  • p-Acetotoluidide, α,α,α-trifluoro-
  • p-(Trifluoromethyl)acetanilide
  • α,α,α-Trifluoro-p-acetotoluidide
  • 4′-(Trifluoromethyl)acetanilide
  • NSC 403019
  • N-Acetyl-4-(trifluoromethyl)aniline

Work with N-[4-(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,N′-Diacetyl-P-phenylenediamine140-50-165 % similar N-(4-Fluorophenyl)acetamide351-83-758 % similar N-[4-Amino-3-(trifluoromethyl)phenyl]acetamide1579-89-155 % similar N-[4-Bromo-3-(trifluoromethyl)phenyl]acetamide41513-05-755 % similar Bromoacetanilide103-88-855 % similar P-Acetotoluidide103-89-955 % similar Acetaminophen103-90-255 % similar Acetanilide103-84-453 % similar

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

Same formula

N-[2-(Trifluoromethyl)phenyl]acetamide344-62-7 N-[3-(Trifluoromethyl)phenyl]acetamide351-36-0 3′-(Trifluoromethyl)acetophenone oxime99705-50-7

Elsewhere

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