2,3-Dibromo-1,4-difluorobenzene

C6H2Br2F2CAS 179737-33-8271.89 g/mol

Open in Covalent MOL file
FBrBrF
Aryl halide

Properties

Molecular formula
C6H2Br2F2
Molar mass
271.89 g/mol
Exact mass
269.8491 Da
logP
3.49Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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
179737-33-8
SMILES
C1=CC(=C(C(=C1F)Br)Br)F
InChIKey
TXTZEQOJTJIFAH-UHFFFAOYSA-N
InChI
InChI=1S/C6H2Br2F2/c7-5-3(9)1-2-4(10)6(5)8/h1-2H

Weigh it out

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Work with 2,3-Dibromo-1,4-difluorobenzene

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-Bromo-1,3,4-trifluorobenzene176793-04-768 % similar 2-Bromo-1,3-difluorobenzene64248-56-267 % similar 1,2-Dibromo-3-fluoro-benzene811711-33-857 % similar 2-Bromo-1-chloro-3-fluorobenzene309721-44-652 % similar 2-Bromo-3-fluoroaniline111721-75-650 % similar 2-Bromo-3-fluorophenol443-81-250 % similar 2-Bromo-1-fluoro-3-methylbenzene59907-13-050 % similar 2-Bromo-3,4-difluoroaniline1092349-87-548 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,2-Dibromo-3,5-difluorobenzene10105-60-9 1,3-Dibromo-2,5-difluorobenzene128259-68-7 1,4-Dibromo-3,5-difluorobenzene128259-71-2 1,2-Dibromo-3,5-difluorobenzene139215-43-3 1,4-Dibromo-2,3-difluorobenzene156682-52-9 1,5-Dibromo-2,4-difluorobenzene28342-75-8 1,4-Dibromo-2,5-difluorobenzene327-51-5 1,2-Dibromo-4,5-difluorobenzene64695-78-9

Elsewhere

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