chempirical

4-Bromo-2,3-dimethylpyridine

C7H8BrNCAS 259807-91-5186.05 g/mol

Open in Covalent MOL file
NBr
Aryl halide

Properties

Molecular formula
C7H8BrN
Molar mass
186.05 g/mol
Exact mass
184.9840 Da
logP
2.46Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
259807-91-5
SMILES
Cc1nccc(Br)c1C
InChIKey
PHCLIPMSNVUELH-UHFFFAOYSA-N
InChI
InChI=1S/C7H8BrN/c1-5-6(2)9-4-3-7(5)8/h3-4H,1-2H3

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Names and synonyms

1 names
  • Pyridine, 4-bromo-2,3-dimethyl-

Work with 4-Bromo-2,3-dimethylpyridine

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

4-Bromo-2-methyl-3-pyridinamine126325-48-259 % similar 4-Bromo-2-fluoro-3-methylpyridine128071-79-459 % similar 2,3-Dimethylpyrazine5910-89-442 % similar 1-Bromo-2,3-dimethylbenzene576-23-841 % similar 2-Bromo-6-chlorotoluene62356-27-840 % similar 3,5-Dibromo-4-methylpyridine3430-23-739 % similar 4-Bromo-3-methylpyridine10168-00-039 % similar 1-Bromo-3-fluoro-2-methylbenzene1422-54-439 % similar

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

Same formula

3-Bromobenzylamine10269-01-9 3-Bromo-2,4-dimethylpyridine27063-93-0 5-Bromo-2-methylbenzenamine39478-78-9 4-Bromobenzenemethanamine3959-07-7 2-Bromo-3-methylbenzenamine54879-20-8 3-Bromo-2-methylaniline55289-36-6 2-Bromo-4-methylaniline583-68-6 4-Bromo-2-methylaniline583-75-5

Elsewhere

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