3-Fluoro-5-iodo bromobenzene

C6H3BrFICAS 845866-85-5300.90 g/mol

Open in Covalent MOL file
BrIF
Aryl halide

Properties

Molecular formula
C6H3BrFI
Molar mass
300.90 g/mol
Exact mass
299.8447 Da
logP
3.19Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 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
845866-85-5
SMILES
C1=C(C=C(C=C1Br)I)F
InChIKey
OQUKJSVQMVBUBY-UHFFFAOYSA-N
InChI
InChI=1S/C6H3BrFI/c7-4-1-5(8)3-6(9)2-4/h1-3H

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Names and synonyms

1 names
  • 1-Bromo-3-fluoro-5-iodobenzene

Work with 3-Fluoro-5-iodo bromobenzene

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

1,3-Dibromo-5-fluorobenzene1435-51-464 % similar 1,3-Dibromo-5-iodobenzene19752-57-964 % similar 1,3-Difluoro-5-iodobenzene2265-91-064 % similar 1-Bromo-3,5-difluorobenzene461-96-164 % similar 1-Bromo-3-chloro-5-iodobenzene13101-40-150 % similar 3-Bromo-5-fluoroaniline134168-97-150 % similar 1-Bromo-3-fluoro-5-methylbenzene202865-83-650 % similar 1-Bromo-3-chloro-5-fluorobenzene33863-76-250 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromo-2-fluoro-1-iodobenzene105931-73-5 3-Iodo-4-fluorobromobenzene116272-41-4 1-Bromo-2-fluoro-4-iodobenzene136434-77-0 1-Bromo-4-fluoro-2-iodobenzene202865-72-3 2-Bromo-4-fluoro-1-iodobenzene202865-73-4 1-Bromo-3-fluoro-2-iodobenzene450412-29-0

Elsewhere

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