1-Bromo-3-(bromomethyl)-2-fluorobenzene

C₇H₅Br₂FCAS 149947-16-0267.92 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

Identifiers

CAS number

149947-16-0

SMILES

Fc1c(Br)cccc1CBr

InChIKey

MGVHFTWDCYIBDO-UHFFFAOYSA-N

InChI

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

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

Names and synonyms

2 names

Benzene, 1-bromo-3-(bromomethyl)-2-fluoro-
1-Bromo-3-bromomethyl-2-fluorobenzene

Work with 1-Bromo-3-(bromomethyl)-2-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

2,3-Difluorobenzyl bromide113211-94-267 % similar 2-Bromobenzyl bromide3433-80-558 % similar 1-(Bromomethyl)-2-fluoro-3-(trifluoromethyl)benzene184970-25-056 % similar 1-Bromo-2,3-difluorobenzene38573-88-550 % similar 2-Fluorobenzyl bromide446-48-048 % similar Xylylene dibromide91-13-448 % similar 3-Bromo-2-fluorobenzenamine58534-95-547 % similar 1-Bromo-2-fluoro-3-methylbenzene59907-12-947 % 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)-5-fluorobenzene216755-57-6 2-Bromo-1-(bromomethyl)-4-fluorobenzene61150-57-0 4-Bromo-2-fluorobenzyl bromide76283-09-5

Elsewhere

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