N-(2,4-Difluorophenyl)acetamide

C₈H₇F₂NOCAS 399-36-0171.15 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₈H₇F₂NO
Molar mass: 171.15 g/mol
Exact mass: 171.0496 Da
Melting point: 121–123 °C
logP: 2.57Crippen estimate
Polar surface area: 32.6 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed84.4% of notifiers
H315 Causes skin irritation15.6% of notifiers
H319 Causes serious eye irritation15.6% of notifiers
H335 May cause respiratory irritation13.3% of notifiers

Aggregated from 45 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

399-36-0

SMILES

CC(O)=Nc1ccc(F)cc1F

InChIKey

WOHLPEUHFSHZAN-UHFFFAOYSA-N

InChI

InChI=1S/C8H7F2NO/c1-5(12)11-8-3-2-6(9)4-7(8)10/h2-4H,1H3,(H,11,12)

Weigh it out

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

Names and synonyms

6 names

Acetamide, N-(2,4-difluorophenyl)-
Acetanilide, 2′,4′-difluoro-
2′,4′-Difluoroacetanilide
N-Acetyl-2,4-difluoroaniline
2,4-Difluoroacetanilide
NSC 51780

Work with 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

4'-Chloro-2'-fluoroacetanilide59280-70-568 % similar N-(2-Bromo-4-fluorophenyl)acetamide1009-22-966 % similar N-(4-Bromo-2-fluorophenyl)acetamide326-66-966 % similar 2'-Chloro-4'-fluoroacetanilide399-35-966 % similar 2′-Fluoroacetanilide399-31-561 % similar 2-(Acetylamino)-4-fluorobenzoic acid394-27-456 % similar 2-Chloro-N-(2,4-difluorophenyl)acetamide96980-65-355 % similar N-(4-Fluorophenyl)acetamide351-83-755 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,2-Difluoro-2-phenylacetamide383-19-7 2-Amino-2',4'-difluoroacetophenone643029-92-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook