1-Bromo-2,5-dichloro-3-fluorobenzene

C6H2BrCl2FCAS 202865-57-4243.88 g/mol

Open in Covalent MOL file
FClBrCl
Aryl halide

Properties

Molecular formula
C6H2BrCl2F
Molar mass
243.88 g/mol
Exact mass
241.8701 Da
logP
3.90Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 11 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, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
202865-57-4
SMILES
Fc1cc(Cl)cc(Br)c1Cl
InChIKey
CAYJMDVKWMVOLG-UHFFFAOYSA-N
InChI
InChI=1S/C6H2BrCl2F/c7-4-1-3(8)2-5(10)6(4)9/h1-2H

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

Names and synonyms

2 names
  • Benzene, 1-bromo-2,5-dichloro-3-fluoro-
  • 3-Bromo-2,5-dichloro-1-fluorobenzene

Work with 1-Bromo-2,5-dichloro-3-fluorobenzene

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

1,5-Dibromo-2-chloro-3-fluorobenzene202925-04-064 % similar 1,2-Dibromo-5-chloro-3-fluorobenzene208186-78-164 % similar 2-Bromo-4-chloro-6-fluorobenzenamine195191-47-060 % similar 1-Bromo-5-chloro-3-fluoro-2-iodobenzene201849-16-360 % similar 2-Bromo-4-chloro-6-fluorophenol886499-88-360 % similar 1-Bromo-2,3,5-trichlorobenzene81067-38-157 % similar 1-Bromo-4-chloro-2-fluorobenzene1996-29-855 % similar 2-Bromo-4-chloro-1-fluorobenzene1996-30-155 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-1,3-dichloro-2-fluorobenzene17318-08-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook