chempirical

2-Chloro-6-fluorobenzamide

C7H5ClFNOCAS 66073-54-9173.57 g/mol

Open in Covalent MOL file
H2NOFCl
Aryl halide

Properties

Molecular formula
C7H5ClFNO
Molar mass
173.57 g/mol
Exact mass
173.0044 Da
Melting point
141–143 °C
logP
2.36Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
1

Identifiers

CAS number
66073-54-9
SMILES
N=C(O)c1c(F)cccc1Cl
InChIKey
KLOZZZNFJYMTNE-UHFFFAOYSA-N
InChI
InChI=1S/C7H5ClFNO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)

Weigh it out

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Names and synonyms

3 names
  • Benzamide, 2-chloro-6-fluoro-
  • NSC 148353
  • 2-Fluoro-6-chlorobenzamide

Work with 2-Chloro-6-fluorobenzamide

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

2,6-Difluorobenzamide18063-03-178 % similar 2,6-Dichlorobenzamide2008-58-471 % similar 2-Chloro-6-fluorobenzoic acid434-75-359 % similar 2-Fluorobenzamide445-28-352 % similar 2-Chlorobenzamide609-66-552 % similar 2,3-Difluorobenzamide18355-75-451 % similar 2-Chloro-6-fluorobenzoyl chloride79455-63-351 % similar 1-Chloro-2-fluorobenzene348-51-647 % similar

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

Same formula

3-Chloro-2-fluorobenzamide104326-94-5 2-Chloro-6-fluorobenzaldehyde oxime443-33-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook