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

C₆H₂BrCl₂FCAS 202865-57-4243.88 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₂BrCl₂F
Molar mass: 243.88 g/mol
Exact mass: 241.8701 Da
logP: 3.90Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

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 2-Bromo-4-chloro-6-fluorophenol886499-88-360 % similar 1-Bromo-2,3,5-trichlorobenzene81067-38-157 % similar 2-Bromo-4-chloro-1-fluorobenzene1996-30-155 % similar 1,3-Dibromo-2-chloro-5-fluorobenzene179897-90-650 % similar 4-Chloro-2,6-difluorobenzenamine69411-06-945 % 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

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