chempirical

4-Chloro-2-methylpyridine

C6H6ClNCAS 3678-63-5127.57 g/mol

Open in Covalent MOL file
ClN
Aryl halide

Properties

Molecular formula
C6H6ClN
Molar mass
127.57 g/mol
Exact mass
127.0189 Da
Boiling point
48.5 °C (at 10 Torr)
logP
2.04Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
3678-63-5
SMILES
Cc1cc(Cl)ccn1
InChIKey
DAOZBJCTEPJGES-UHFFFAOYSA-N
InChI
InChI=1S/C6H6ClN/c1-5-4-6(7)2-3-8-5/h2-4H,1H3

Weigh it out

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

Names and synonyms

4 names
  • Pyridine, 4-chloro-2-methyl-
  • 2-Picoline, 4-chloro-
  • 4-Chloro-2-picoline
  • 2-Methyl-4-chloropyridine

Work with 4-Chloro-2-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

2,4-Lutidine108-47-454 % similar 2,4-Dichloropyridine26452-80-254 % similar 4-Chloro-2-fluoropyridine34941-92-950 % similar 4-Chloro-2-phenylpyridine57311-18-947 % similar 2-Chloro-4-methylpyrimidine13036-57-246 % similar 5-Chloro-2-methylpyridine72093-07-346 % similar 2-Trifluoromethyl-4-chloropyridine131748-14-645 % similar 4-Chloro-2-cyanopyridine19235-89-345 % similar

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

Same formula

4-Chloroaniline106-47-8 3-Chloroaniline108-42-9 2-Chloro-6-methylpyridine18368-63-3 2-Chloro-5-methylpyridine18368-64-4 2-Chloro-3-methylpyridine18368-76-8 2-Chloro-4-methylpyridine3678-62-4 2-Chloromethylpyridine4377-33-7 3-Chloro-4-methylpyridine72093-04-0

Elsewhere

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