chempirical

3-Chloro-4-fluoroaniline

C6H5ClFNCAS 367-21-5145.56 g/mol

Open in Covalent MOL file
H2NFCl
Aryl halidePrimary amine

Properties

Molecular formula
C6H5ClFN
Molar mass
145.56 g/mol
Exact mass
145.0095 Da
Melting point
45.5 °C
Boiling point
227.5 °C
logP
2.06Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
367-21-5
SMILES
Nc1ccc(F)c(Cl)c1
InChIKey
YSEMCVGMNUUNRK-UHFFFAOYSA-N
InChI
InChI=1S/C6H5ClFN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2

Weigh it out

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

Names and synonyms

7 names
  • Benzenamine, 3-chloro-4-fluoro-
  • Aniline, 3-chloro-4-fluoro-
  • 3-Chloro-4-fluorobenzenamine
  • 4-Fluoro-3-chloroaniline
  • m-Chloro-p-fluoroaniline
  • 3-Chloro-4-fluorophenylamine
  • NSC 10290

Work with 3-Chloro-4-fluoroaniline

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3,4-Difluoroaniline3863-11-460 % similar 3,4-Dichloroaniline95-76-160 % similar 2,4-Dichlorofluorobenzene1435-48-956 % similar 2-Chloro-P-phenylenediamine615-66-756 % similar 4-Fluoro-1,3-phenylenediamine6264-67-156 % similar 2-Chloro-1-fluoro-4-methylbenzene1513-25-354 % similar 3,5-Dichloro-4-fluorobenzenamine2729-34-252 % similar 3-Chloro-4-iodobenzenamine135050-44-152 % similar

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

Same formula

2-Chloro-4-fluorobenzenamine2106-02-7 3-Chloro-2-fluorobenzenamine2106-04-9 5-Chloro-2-fluoroaniline2106-05-0 2-Chloro-3-fluorobenzenamine21397-08-0 2-Chloro-3-fluoro-5-methylpyridine34552-15-3 2-Chloro-6-fluoroaniline363-51-9 4-Chloro-3-fluorobenzenamine367-22-6 2-Chloro-3-fluoro-6-methylpyridine374633-32-6

Elsewhere

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