2,5,6-Tribromo-3-methylpyridine

C₆H₄Br₃NCAS 393516-82-0329.82 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₄Br₃N
Molar mass: 329.82 g/mol
Exact mass: 326.7894 Da
logP: 3.68Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

393516-82-0

SMILES

CC1=CC(=C(N=C1Br)Br)Br

InChIKey

XXEWSVZWDLDXRE-UHFFFAOYSA-N

InChI

InChI=1S/C6H4Br3N/c1-3-2-4(7)6(9)10-5(3)8/h2H,1H3

Weigh it out

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

Work with 2,5,6-Tribromo-3-methylpyridine

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

2,6-Dibromo-3,5-dimethylpyridine117846-58-973 % similar 2,5-Dibromo-p-xylene1074-24-452 % similar 4,5-Dibromo-O-xylene24932-48-752 % similar 2,3-Dibromo-6-methylpyridine261373-04-050 % similar 2,4,5-Tribromotoluene3278-88-448 % similar 1-Bromo-2,4,5-trimethylbenzene5469-19-248 % similar 3,6-Dibromo-4-methylpyridazine89284-10-645 % similar 1,5-Dibromo-2,4-dimethylbenzene615-87-244 % similar

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

Same formula

2,4,6-Tribromoaniline147-82-0

Elsewhere

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