chempirical

3-Chloro-2-fluorobenzenamine

C6H5ClFNCAS 2106-04-9145.56 g/mol

Open in Covalent MOL file
H2NClF
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

Identifiers

CAS number
2106-04-9
SMILES
Nc1cccc(Cl)c1F
InChIKey
XWBTZHDDWRNOQH-UHFFFAOYSA-N
InChI
InChI=1S/C6H5ClFN/c7-4-2-1-3-5(9)6(4)8/h1-3H,9H2

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

Names and synonyms

5 names
  • Benzenamine, 3-chloro-2-fluoro-
  • Aniline, 3-chloro-2-fluoro-
  • 3-Chloro-2-fluoroaniline
  • 2-Fluoro-3-chloroaniline
  • (3-Chloro-2-fluorophenyl)amine

Work with 3-Chloro-2-fluorobenzenamine

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

1,3-Dichloro-2-fluorobenzene2268-05-564 % similar 2-Chloroaniline95-51-258 % similar 2,3-Difluoroaniline4519-40-858 % similar 3-Bromo-2-fluorobenzenamine58534-95-556 % similar 2,3-Dichloroaniline608-27-554 % similar o-Chloroaniline hydrochloride137-04-252 % similar 3-Chloro-2-methylaniline87-60-552 % similar 3,5-Dichloro-2,4-difluorobenzenamine83121-15-752 % similar

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

Same formula

2-Chloro-4-fluorobenzenamine2106-02-7 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 3-Chloro-4-fluoroaniline367-21-5 4-Chloro-3-fluorobenzenamine367-22-6 2-Chloro-3-fluoro-6-methylpyridine374633-32-6

Elsewhere

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