chempirical

2-Chloromethylpyridine

C6H6ClNCAS 4377-33-7127.57 g/mol

Open in Covalent MOL file
ClN
Alkyl halide

Properties

Molecular formula
C6H6ClN
Molar mass
127.57 g/mol
Exact mass
127.0189 Da
Melting point
79 °C
Boiling point
73–76 °C (at 10 Torr)
logP
1.82Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
4377-33-7
SMILES
ClCc1ccccn1
InChIKey
NJWIMFZLESWFIM-UHFFFAOYSA-N
InChI
InChI=1S/C6H6ClN/c7-5-6-3-1-2-4-8-6/h1-4H,5H2

Weigh it out

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

Names and synonyms

9 names
  • Pyridine, 2-(chloromethyl)-
  • 2-(Chloromethyl)pyridine
  • 2-Picolyl chloride
  • 2-Pyridinemethyl chloride
  • 2-Pyridylmethyl chloride
  • 2-Pyridinylmethyl chloride
  • α-Picolyl chloride
  • Picolyl chloride
  • 2-Picolinyl chloride

Work with 2-Chloromethylpyridine

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

Picolyl chloride hydrochloride6959-47-387 % similar 2-Ethylpyridine100-71-054 % similar Dipicolylamine1539-42-054 % similar 2-Pyridinemethanethiol2044-73-754 % similar 2-Picolylamine3731-51-954 % similar 2-Pyridinemethanol586-98-154 % similar 2-(Methoxymethyl)pyridine23579-92-254 % similar 2-(Phenylmethyl)pyridine101-82-652 % 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 4-Chloro-2-methylpyridine3678-63-5 3-Chloro-4-methylpyridine72093-04-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia