chempirical

3-Bromo-2-chloro-6-picoline

C6H5BrClNCAS 185017-72-5206.47 g/mol

Open in Covalent MOL file
NBrCl
Aryl halide

Properties

Molecular formula
C6H5BrClN
Molar mass
206.47 g/mol
Exact mass
204.9294 Da
logP
2.81Crippen estimate
Polar surface area
12.9 Ų
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
185017-72-5
SMILES
CC1=NC(=C(C=C1)Br)Cl
InChIKey
JVDQYSIJBRTRMS-UHFFFAOYSA-N
InChI
InChI=1S/C6H5BrClN/c1-4-2-3-5(7)6(8)9-4/h2-3H,1H3

Weigh it out

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Names and synonyms

1 names
  • 3-Bromo-2-chloro-6-methylpyridine

Work with 3-Bromo-2-chloro-6-picoline

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-Dibromo-6-methylpyridine261373-04-057 % similar 3-Bromo-2,6-dimethylpyridine3430-31-757 % similar 3-Bromo-2,6-dichloropyridine866755-20-657 % similar 3,6-Dibromo-2-chloropyridine942206-18-057 % similar 2-Amino-3-bromo-6-methylpyridine126325-46-053 % similar 2-Chloro-3-fluoro-6-methylpyridine374633-32-653 % similar 3-Bromo-2-fluoro-6-picoline375368-78-853 % similar 3-Amino-2-chloro-6-picoline39745-40-953 % similar

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

Same formula

3-Bromo-6-chloro-2-methylpyridine132606-40-7 3-Bromo-2-chloro-5-methylpyridine17282-03-0 4-Bromo-3-chloroaniline21402-26-6 5-Bromo-2-chloro-3-methylpyridine29241-60-9 4-Bromo-2-chloroaniline38762-41-3 3-Bromo-2-chloro-4-methylpyridine55404-31-4 5-Bromo-2-chloroaniline60811-17-8 2-Bromo-5-chloro-3-methylpyridine65550-77-8

Elsewhere

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