3-Bromo-4,5-dichloropyridine

C₅H₂BrCl₂NCAS 1001056-83-2226.88 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₂BrCl₂N
Molar mass: 226.88 g/mol
Exact mass: 224.8748 Da
logP: 3.15Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

1001056-83-2

SMILES

C1=C(C(=C(C=N1)Br)Cl)Cl

InChIKey

YPRODAZVOKKURG-UHFFFAOYSA-N

InChI

InChI=1S/C5H2BrCl2N/c6-3-1-9-2-4(7)5(3)8/h1-2H

Weigh it out

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Work with 3-Bromo-4,5-dichloropyridine

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-2,3-dichlorobenzene56961-77-450 % similar 1-Bromo-2,3,5-trichlorobenzene81067-38-145 % similar 3,5-Dibromo-4-methylpyridine3430-23-741 % similar 5-Bromo-4-chloropyrimidine56181-39-640 % similar 3,4,5-Trichloropyridazine14161-11-637 % similar 4-Bromoisoquinoline1532-97-434 % similar 4,5-Dichloro-3(2H)-pyridazinone932-22-934 % similar 4-Bromo-1H-pyrazolo[3,4-C]pyridine1032943-43-333 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Bromo-2,5-dichloropyridine138006-41-4 3-Bromo-2,4-dichloropyridine144584-32-7

Elsewhere

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