3,5-Dibromobenzyl bromide

C₇H₅Br₃CAS 56908-88-4328.83 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₇H₅Br₃
Molar mass: 328.83 g/mol
Exact mass: 325.7941 Da
logP: 4.11Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

56908-88-4

SMILES

C1=C(C=C(C=C1Br)Br)CBr

InChIKey

PWTFRUXTAFBWBW-UHFFFAOYSA-N

InChI

InChI=1S/C7H5Br3/c8-4-5-1-6(9)3-7(10)2-5/h1-3H,4H2

Weigh it out

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

Work with 3,5-Dibromobenzyl bromide

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-Bromo-3-(bromomethyl)-5-fluorobenzene216755-57-667 % similar 1,3,5-Tris(bromomethyl)benzene18226-42-161 % similar 3-Bromobenzyl bromide823-78-958 % similar 4-Bromobenzyl bromide589-15-155 % similar 1,3,5-Tribromobenzene626-39-153 % similar (3,5-Dibromophenyl)methanol145691-59-452 % similar 3,5-Difluorobenzyl bromide141776-91-246 % similar 3,5-Bis(bromomethyl)toluene19294-04-346 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,4,5-Tribromotoluene3278-88-4 2,4,6-Tribromotoluene6320-40-7

Elsewhere

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