5-Chloro-2-fluoroaniline

C6H5ClFNCAS 2106-05-0145.56 g/mol

Open in Covalent MOL file
NH2ClF
Aryl halidePrimary amine

Properties

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

Hazards

Warning
Irritant (GHS07)

Aggregated from 50 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
2106-05-0
SMILES
Nc1cc(Cl)ccc1F
InChIKey
JCYROOANFKVAIB-UHFFFAOYSA-N
InChI
InChI=1S/C6H5ClFN/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H2

Weigh it out

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

Names and synonyms

7 names
  • Benzenamine, 5-chloro-2-fluoro-
  • Aniline, 5-chloro-2-fluoro-
  • 5-Chloro-2-fluorobenzenamine
  • NSC 10291
  • (5-Chloro-2-fluorophenyl)amine
  • 3-Chloro-6-fluoroaniline
  • 3-Chloro-6-fluorobenzenamine

Work with 5-Chloro-2-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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Chloro-2-fluoroaniline57946-56-269 % similar 4-Chloro-1,2-difluorobenzene696-02-660 % similar 4-Chloro-1,2-phenylenediamine95-83-060 % similar 2,4-Dichlorofluorobenzene1435-48-956 % similar 2,5-Difluoroaniline367-30-656 % similar 4-Fluorobenzene-1,3-diamine6264-67-156 % similar 2,5-Dichloroaniline95-82-956 % similar 2-Amino-4-chlorothiophenol1004-00-852 % 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 2-Chloro-3-fluorobenzenamine21397-08-0 2-Chloro-3-fluoro-5-methylpyridine34552-15-3 2-Chloro-6-fluoroaniline363-51-9 3-Chloro-4-fluoroaniline367-21-5 4-Chloro-3-fluorobenzenamine367-22-6 2-Chloro-3-fluoro-6-methylpyridine374633-32-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook