2-Bromo-4-chloro-6-fluorobenzenamine

C6H4BrClFNCAS 195191-47-0224.46 g/mol

Open in Covalent MOL file
H2NFClBr
Aryl halidePrimary amine

Properties

Molecular formula
C6H4BrClFN
Molar mass
224.46 g/mol
Exact mass
222.9200 Da
logP
2.82Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
195191-47-0
SMILES
Nc1c(F)cc(Cl)cc1Br
InChIKey
HBHBARSMRVAINH-UHFFFAOYSA-N
InChI
InChI=1S/C6H4BrClFN/c7-4-1-3(8)2-5(9)6(4)10/h1-2H,10H2

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Names and synonyms

2 names
  • Benzenamine, 2-bromo-4-chloro-6-fluoro-
  • 2-Bromo-4-chloro-6-fluoroaniline

Work with 2-Bromo-4-chloro-6-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

4-Chloro-2,6-difluorobenzenamine69411-06-969 % similar 2,6-Dibromo-4-chloroaniline874-17-969 % similar 2,4-Dibromo-6-fluoroaniline141474-37-560 % similar 1-Bromo-2,5-dichloro-3-fluorobenzene202865-57-460 % similar 1,2-Dibromo-5-chloro-3-fluorobenzene208186-78-160 % similar 2-Bromo-4,6-difluorobenzenamine444-14-460 % similar 2-Bromo-4,6-dichloroaniline697-86-960 % similar 1-Bromo-5-chloro-3-fluoro-2-iodobenzene201849-16-356 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromo-3-chloro-2-fluoroaniline115843-99-7 2-Bromo-6-chloro-4-fluorobenzenamine201849-14-1

Elsewhere

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