chempirical

3-Bromo-6-methylpyridine-2-carbonitrile

C7H5BrN2CAS 717843-48-6197.03 g/mol

Open in Covalent MOL file
NBrN
Aryl halideNitrile

Properties

Molecular formula
C7H5BrN2
Molar mass
197.03 g/mol
Exact mass
195.9636 Da
logP
2.02Crippen estimate
Polar surface area
36.7 Ų
H-bond donors / acceptors
0 / 2
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
717843-48-6
SMILES
CC1=NC(=C(C=C1)Br)C#N
InChIKey
ARSYSTQQVJUEBW-UHFFFAOYSA-N
InChI
InChI=1S/C7H5BrN2/c1-5-2-3-6(8)7(4-9)10-5/h2-3H,1H3

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Names and synonyms

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

Work with 3-Bromo-6-methylpyridine-2-carbonitrile

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-methylpyridine261373-04-052 % similar 3-Bromo-2,6-dimethylpyridine3430-31-752 % similar 2-Amino-3-bromo-6-methylpyridine126325-46-048 % similar 3-Bromo-2-chloro-6-picoline185017-72-548 % similar 3-Bromo-2-fluoro-6-picoline375368-78-848 % similar 3-Bromopyridine-2-carbonitrile55758-02-648 % similar 2-Bromo-5-methylbenzonitrile42872-83-346 % similar 2-Chloro-6-methyl-3-pyridinecarbonitrile28900-10-944 % similar

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

Same formula

5-Bromo-4-azaindole1000341-51-4 2-Bromo-5-cyano-4-picoline1003711-35-0 5-Bromopyrazolo[1,5-A]pyridine1060812-84-1 2-Amino-3-bromobenzonitrile114344-60-4 5-Bromo-1H-pyrrolo[2,3-c]pyridine1215387-58-8 6-Bromopyrazolo(1,5-a)pyridine1264193-11-4 6-Bromo-1H-pyrrolo[2,3-B]pyridine143468-13-7 5-Bromo-3-methylpyridine-2-carbonitrile156072-86-5

Elsewhere

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