2-Chloro-N-(2,4-difluorophenyl)acetamide

C8H6ClF2NOCAS 96980-65-3205.59 g/mol

Open in Covalent MOL file
OClHNFF
Alkyl halideAryl halide

Properties

Molecular formula
C8H6ClF2NO
Molar mass
205.59 g/mol
Exact mass
205.0106 Da
logP
2.79Crippen estimate
Polar surface area
32.6 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
96980-65-3
SMILES
OC(CCl)=Nc1ccc(F)cc1F
InChIKey
TUPPVAAGWXKMRC-UHFFFAOYSA-N
InChI
InChI=1S/C8H6ClF2NO/c9-4-8(13)12-7-2-1-5(10)3-6(7)11/h1-3H,4H2,(H,12,13)

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Names and synonyms

2 names
  • Acetamide, 2-chloro-N-(2,4-difluorophenyl)-
  • N-Chloroacetyl-2,4-difluoroaniline

Work with 2-Chloro-N-(2,4-difluorophenyl)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

2-Chloro-N-(2-fluorophenyl)acetamide347-66-064 % similar N-(2,4-Difluorophenyl)acetamide399-36-055 % similar 2-Chloro-1-(2,4-difluorophenyl)ethanone51336-94-846 % similar 2-Chloro-2',5'-difluoroacetophenone60468-36-243 % similar 2,4-Difluoro-1-isothiocyanatobenzene141106-52-743 % similar 2,4-Difluorophenyl isocyanate59025-55-743 % similar 2,4-Difluorobenzamide85118-02-143 % similar 2-Chloro-N-(3,5-dichlorophenyl)acetamide33560-48-442 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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