2-Bromo-4-iodopyridine

C₅H₃BrINCAS 100523-96-4283.89 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₅H₃BrIN
Molar mass: 283.89 g/mol
Exact mass: 282.8494 Da
logP: 2.45Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed11.1% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation88.9% of notifiers

Aggregated from 9 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

100523-96-4

SMILES

C1=CN=C(C=C1I)Br

InChIKey

HPKRNLGLZYOVJS-UHFFFAOYSA-N

InChI

InChI=1S/C5H3BrIN/c6-5-3-4(7)1-2-8-5/h1-3H

Weigh it out

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

Work with 2-Bromo-4-iodopyridine

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

2,4-Dibromopyridine58530-53-354 % similar 2-Chloro-4-iodopyridine153034-86-750 % similar 2-Fluoro-4-iodopyridine22282-70-850 % similar 2-Bromo-4-chloropyridine22918-01-050 % similar 2-Bromo-4-fluoropyridine357927-50-550 % similar 2-Bromo-4-methylpyridine4926-28-750 % similar 4-Amino-2-bromopyridine7598-35-850 % similar 2-Bromo-4-cyanopyridine10386-27-345 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Bromo-2-iodopyridine223463-13-6 3-Bromo-5-iodopyridine233770-01-9 2-Bromo-6-iodopyridine234111-08-1 2-Bromo-3-iodopyridine265981-13-3 2-Bromo-5-iodopyridine73290-22-9

Elsewhere

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