1-Bromo-3-fluorobenzene

C₆H₄BrFCAS 1073-06-9175.00 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₆H₄BrF
Molar mass: 175.00 g/mol
Exact mass: 173.9480 Da
Density: 1.5862 g/mL (at 25 °C)
Boiling point: 150 °C
logP: 2.59Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Warning

H226 Flammable liquid and vapor97.5% of notifiers
H302 Harmful if swallowed94.9% of notifiers
H315 Causes skin irritation96.2% of notifiers
H319 Causes serious eye irritation94.9% of notifiers

Aggregated from 79 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P264, P264+P265, P270, P280, P301+P317, P302+P352, P303+P361+P353, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, P501

Identifiers

CAS number

1073-06-9

SMILES

Fc1cccc(Br)c1

InChIKey

QDFKKJYEIFBEFC-UHFFFAOYSA-N

InChI

InChI=1S/C6H4BrF/c7-5-2-1-3-6(8)4-5/h1-4H

Weigh it out

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

Names and synonyms

11 names

Benzene, 1-bromo-3-fluoro-
1-Fluoro-3-bromobenzene
m-Bromofluorobenzene
m-Fluorobromobenzene
m-Fluorophenyl bromide
3-Bromofluorobenzene
3-Fluorobromobenzene
3-Fluorophenyl bromide
3-Fluoro-1-bromobenzene
3-Bromo-1-fluorobenzene
NSC 10267

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

Similar compounds

1,3-Dibromobenzene108-36-163 % similar 1,3-Difluorobenzene372-18-958 % similar 1,3-Dibromo-5-fluorobenzene1435-51-457 % similar 1-Bromo-3,5-difluorobenzene461-96-157 % similar 2-Bromo-6-fluoronaphthalene324-41-456 % similar 3-Bromo-4'-fluorodiphenyl ether50904-38-655 % similar 3,3''-Dibromo-1,1':3',1''-terphenyl95962-62-252 % similar 1-Bromo-3-chlorobenzene108-37-250 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-Bromo-2-fluorobenzene1072-85-1 4-Fluorobromobenzene460-00-4

Elsewhere

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