1-Bromo-2,4-difluorobenzene

C₆H₃BrF₂CAS 348-57-2192.99 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₆H₃BrF₂
Molar mass: 192.99 g/mol
Exact mass: 191.9386 Da
Melting point: −8 °C
Boiling point: 146 °C
logP: 2.73Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Warning

H226 Flammable liquid and vapor95.6% of notifiers
H315 Causes skin irritation94.7% of notifiers
H319 Causes serious eye irritation94.7% of notifiers
H335 May cause respiratory irritation93.8% of notifiers

Aggregated from 113 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

348-57-2

SMILES

Fc1ccc(Br)c(F)c1

InChIKey

MGHBDQZXPCTTIH-UHFFFAOYSA-N

InChI

InChI=1S/C6H3BrF2/c7-5-2-1-4(8)3-6(5)9/h1-3H

Weigh it out

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

Names and synonyms

5 names

Benzene, 1-bromo-2,4-difluoro-
2,4-Difluorobromobenzene
2,4-Difluoro-1-bromobenzene
2,4-Difluorophenyl bromide
4-Bromo-1,3-difluorobenzene

Work with 1-Bromo-2,4-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,2-Dibromo-4-fluorobenzene2369-37-165 % similar 1,4-Dibromo-2-fluorobenzene1435-52-560 % similar 1,2,4-Trifluorobenzene367-23-757 % similar 2-Bromo-5-fluorobenzenamine1003-99-256 % similar 1-Bromo-2-chloro-4-fluorobenzene110407-59-556 % similar 4-Bromo-3-fluorophenol121219-03-256 % similar 1-Bromo-2-fluoro-4-iodobenzene136434-77-056 % similar 2-Bromo-5-fluorophenol147460-41-156 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Bromo-3,4-difluorobenzene348-61-8 1-Bromo-2,3-difluorobenzene38573-88-5 1-Bromo-2,5-difluorobenzene399-94-0 1-Bromo-3,5-difluorobenzene461-96-1 2-Bromo-1,3-difluorobenzene64248-56-2

Elsewhere

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