2-Bromo-1-(bromomethyl)-4-fluorobenzene

C₇H₅Br₂FCAS 61150-57-0267.92 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₇H₅Br₂F
Molar mass: 267.92 g/mol
Exact mass: 265.8742 Da
logP: 3.48Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Hazards

Danger

H290 May be corrosive to metals50% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, P501

Identifiers

CAS number

61150-57-0

SMILES

Fc1ccc(CBr)c(Br)c1

InChIKey

QPLUIZXBWYUFMY-UHFFFAOYSA-N

InChI

InChI=1S/C7H5Br2F/c8-4-5-1-2-6(10)3-7(5)9/h1-3H,4H2

Weigh it out

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

Names and synonyms

3 names

Benzene, 2-bromo-1-(bromomethyl)-4-fluoro-
2-Bromo-4-fluorobenzyl bromide
2-Bromo-1-bromomethyl-4-fluorobenzene

Work with 2-Bromo-1-(bromomethyl)-4-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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Bromo-4-fluorobenzyl alcohol229027-89-863 % similar 2,4-Difluorobenzyl bromide23915-07-362 % similar 2-Chloro-4-fluorobenzyl bromide45767-66-658 % similar 2,5-Difluorobenzyl bromide85117-99-357 % similar 1,2-Dibromo-4-fluorobenzene2369-37-156 % similar 4-Fluoro-2-(trifluoromethyl)benzyl bromide206860-48-255 % similar 1,4-Dibromo-2,5-bis(bromomethyl)benzene35335-16-154 % similar 2-(Bromomethyl)-4-fluoro-1-methylbenzene261951-71-753 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Bromo-2-(bromomethyl)-4-fluorobenzene112399-50-5 2-Bromo-1-(bromomethyl)-3-fluorobenzene1184918-22-6 1-Bromo-4-(bromomethyl)-2-fluorobenzene127425-73-4 1-Bromo-3-(bromomethyl)-2-fluorobenzene149947-16-0 1-Bromo-3-(bromomethyl)-5-fluorobenzene216755-57-6 4-Bromo-2-fluorobenzyl bromide76283-09-5 3-Bromo-4-fluorobenzyl bromide78239-71-1

Elsewhere

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