chempirical

2-Chloro-6-fluoroaniline

C6H5ClFNCAS 363-51-9145.56 g/mol

Open in Covalent MOL file
NH2FCl
Aryl halidePrimary amine

Properties

Molecular formula
C6H5ClFN
Molar mass
145.56 g/mol
Exact mass
145.0095 Da
Density
1.316 g/mL (at 23 °C)
Melting point
31–32 °C
Boiling point
91 °C (at 30 Torr)
logP
2.06Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
363-51-9
SMILES
Nc1c(F)cccc1Cl
InChIKey
ZJLAWMDJTMMTQB-UHFFFAOYSA-N
InChI
InChI=1S/C6H5ClFN/c7-4-2-1-3-5(8)6(4)9/h1-3H,9H2

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Names and synonyms

5 names
  • Benzenamine, 2-chloro-6-fluoro-
  • Aniline, 2-chloro-6-fluoro-
  • 2-Chloro-6-fluorobenzenamine
  • 2-Chloro-6-fluorophenylamine
  • 2-Fluoro-6-chloroaniline

Work with 2-Chloro-6-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

2,6-Difluoroaniline5509-65-968 % similar 1-Chloro-2-fluorobenzene348-51-658 % similar 2-Bromo-6-fluorobenzenamine65896-11-956 % similar 1,2-Dichloro-3-fluorobenzene36556-50-054 % similar 1-Chloro-3-fluoro-2-iodobenzene127654-70-050 % similar 2-Chloro-6-fluorobenzenemethanamine15205-15-950 % similar 2-Chloro-6-fluorophenol2040-90-650 % similar 2-Chloro-6-(trifluoromethyl)benzenamine433-94-350 % 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 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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