1,2-Dibromo-4-fluorobenzene

C6H3Br2FCAS 2369-37-1253.90 g/mol

Open in Covalent MOL file
FBrBr
Aryl halide

Properties

Molecular formula
C6H3Br2F
Molar mass
253.90 g/mol
Exact mass
251.8586 Da
Melting point
69 °C
Boiling point
87 °C (at 13 Torr)
logP
3.35Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
2369-37-1
SMILES
Fc1ccc(Br)c(Br)c1
InChIKey
RNTGKISRXVFIIP-UHFFFAOYSA-N
InChI
InChI=1S/C6H3Br2F/c7-5-2-1-4(9)3-6(5)8/h1-3H

Weigh it out

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Names and synonyms

3 names
  • Benzene, 1,2-dibromo-4-fluoro-
  • 3,4-Dibromofluorobenzene
  • 3,4-Dibromo-1-fluorobenzene

Work with 1,2-Dibromo-4-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-Bromo-2,4-difluorobenzene348-57-265 % similar 1-Bromo-2,5-difluorobenzene399-94-065 % similar 2-Bromo-4-fluoroaniline1003-98-160 % similar 2-Bromo-5-fluorobenzenamine1003-99-260 % similar 1-Bromo-2-chloro-4-fluorobenzene110407-59-560 % similar 2-Bromo-4-fluorotoluene1422-53-360 % similar 2-Bromo-5-fluorophenol147460-41-160 % similar 2-Bromo-1-chloro-4-fluorobenzene201849-15-260 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,3-Dibromo-5-fluorobenzene1435-51-4 1,4-Dibromo-2-fluorobenzene1435-52-5 2,4-Dibromo-1-fluorobenzene1435-53-6 1,2-Dibromo-3-fluoro-benzene811711-33-8

Elsewhere

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