2-Chloro-N-(4-fluorophenyl)acetamide

C₈H₇ClFNOCAS 351-04-2187.60 g/mol

Open in Covalent MOL file

Alkyl halide Amide Aryl halide

Properties

Molecular formula: C₈H₇ClFNO
Molar mass: 187.60 g/mol
Exact mass: 187.0200 Da
logP: 2.00Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation13.6% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation13.6% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

351-04-2

SMILES

C1=CC(=CC=C1NC(=O)CCl)F

InChIKey

JDAWWCJBFPBHFL-UHFFFAOYSA-N

InChI

InChI=1S/C8H7ClFNO/c9-5-8(12)11-7-3-1-6(10)2-4-7/h1-4H,5H2,(H,11,12)

Weigh it out

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

Names and synonyms

1 names

N-(Chloroacetyl)-4-fluoroaniline

Work with 2-Chloro-N-(4-fluorophenyl)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-Chlorophenyl)-2-chloroacetamide3289-75-666 % similar 2-Chloro-N-(4-methylphenyl)acetamide16634-82-564 % similar N-(4-Bromophenyl)-2-chloroacetamide2564-02-564 % similar N-(Chloroacetyl)-4-(trifluoromethyl)aniline2707-23-563 % similar 2-Chloro-N-(3-chloro-4-fluorophenyl)acetamide96980-64-262 % similar 2-Chloro-N-(4-isopropylphenyl)acetamide1527-61-358 % similar 2-Chloro-N-(4-methoxyphenyl)acetamide22303-36-258 % similar 2-Chloro-N-[4-(trifluoromethoxy)phenyl]acetamide161290-85-358 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Chloro-N-(2-fluorophenyl)acetamide347-66-0 2-Chloro-N-(3-fluorophenyl)acetamide350-81-2 2'-Chloro-4'-fluoroacetanilide399-35-9 4'-Chloro-2'-fluoroacetanilide59280-70-5

Elsewhere

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