1,4-Dibromo-3,5-difluorobenzene

C₆H₂Br₂F₂CAS 128259-71-2271.89 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₂Br₂F₂
Molar mass: 271.89 g/mol
Exact mass: 269.8491 Da
logP: 3.49Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation50% of notifiers
H332 Harmful if inhaled50% of notifiers

Aggregated from 2 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, P317, P321, P330, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

128259-71-2

SMILES

C1=C(C=C(C(=C1F)Br)F)Br

InChIKey

OCUXAWVQPORIBP-UHFFFAOYSA-N

InChI

InChI=1S/C6H2Br2F2/c7-3-1-4(9)6(8)5(10)2-3/h1-2H

Weigh it out

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

Names and synonyms

1 names

2,5-Dibromo-1,3-difluorobenzene

Work with 1,4-Dibromo-3,5-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

1,2,5-Tribromo-3-fluorobenzene2839-37-473 % similar 5-Bromo-1,2,3-trifluorobenzene138526-69-962 % similar 2-Bromo-1,3,5-trifluorobenzene2367-76-262 % similar 4-Bromo-2,6-difluorophenol104197-13-957 % similar 4-Bromo-3,5-difluorophenol130191-91-257 % similar 2-Bromo-1,3-difluoro-5-iodobenzene155906-10-857 % similar 5-Bromo-1,3-difluoro-2-iodobenzene160976-02-357 % similar 5-Bromo-2-chloro-1,3-difluorobenzene176673-72-657 % 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 1,2-Dibromo-3,5-difluorobenzene139215-43-3 1,4-Dibromo-2,3-difluorobenzene156682-52-9 2,3-Dibromo-1,4-difluorobenzene179737-33-8 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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