chempirical

4-Chloropyridine

C5H4ClNCAS 626-61-9113.54 g/mol

Open in Covalent MOL file
ClN
Aryl halide

Properties

Molecular formula
C5H4ClN
Molar mass
113.54 g/mol
Exact mass
113.0032 Da
Melting point
−43.5 °C
Boiling point
147.5 °C
logP
1.74Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
626-61-9
SMILES
Clc1ccncc1
InChIKey
PVMNPAUTCMBOMO-UHFFFAOYSA-N
InChI
InChI=1S/C5H4ClN/c6-5-1-3-7-4-2-5/h1-4H

Weigh it out

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

Names and synonyms

2 names
  • Pyridine, 4-chloro-
  • γ-Chloropyridine

Work with 4-Chloropyridine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Chloropyridine hydrochloride7379-35-382 % similar 1,4-Dichlorobenzene106-46-753 % similar 4-(4-Chlorobenzoyl)pyridine14548-48-252 % similar 4,4'-Bipyridine553-26-447 % similar 4-Chlorobenzenethiol106-54-745 % similar Chlorobenzene108-90-744 % similar 1,4-Bis(pyrid-4-yl)benzene113682-56-744 % similar 4,4′-Dichlorobiphenyl2050-68-244 % similar

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

Same formula

2-Chloropyridine109-09-1 3-Chloropyridine626-60-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook