N-[2-(Trifluoromethyl)phenyl]acetamide

C₉H₈F₃NOCAS 344-62-7203.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₈F₃NO
Molar mass: 203.16 g/mol
Exact mass: 203.0558 Da
Melting point: 96 °C
logP: 3.31Crippen estimate
Polar surface area: 32.6 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H319 Causes serious eye irritation97.7% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled90.7% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P233, P260, P264, P264+P265, P270, P271, P280, P284, P301+P317, P304+P340, P305+P351+P338, P330, P337+P317, P342+P316, P403, P501

Identifiers

CAS number

344-62-7

SMILES

CC(O)=Nc1ccccc1C(F)(F)F

InChIKey

OXDTZGRSCDEKGO-UHFFFAOYSA-N

InChI

InChI=1S/C9H8F3NO/c1-6(14)13-8-5-3-2-4-7(8)9(10,11)12/h2-5H,1H3,(H,13,14)

Weigh it out

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

Names and synonyms

8 names

Acetamide, N-[2-(trifluoromethyl)phenyl]-
o-Acetotoluidide, α,α,α-trifluoro-
2′-(Trifluoromethyl)acetanilide
α,α,α-Trifluoro-o-acetotoluidide
NSC 88329
2-Trifluoromethylacetanilide
o-Trifluoromethylpropionanilide
2-Acetamidotrifluoromethylbenzene

Work with N-[2-(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-[4-Iodo-2-(trifluoromethyl)phenyl]acetamide97760-98-061 % similar 2′-Fluoroacetanilide399-31-556 % similar N-(2-Methylphenyl)acetamide120-66-153 % similar N-(2-Bromophenyl)acetamide614-76-653 % similar 2-Acetamidophenol614-80-253 % similar N-(2-Chlorophenyl)acetamide533-17-551 % similar N-1-Naphthylacetamide575-36-050 % similar N-(4-Amino-3-(trifluoromethyl)phenyl)acetamide1579-89-149 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-[4-(Trifluoromethyl)phenyl]acetamide349-97-3 N-[3-(Trifluoromethyl)phenyl]acetamide351-36-0 3′-(Trifluoromethyl)acetophenone oxime99705-50-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook