chempirical

2-(4-Chlorophenyl)pyridine

C11H8ClNCAS 5969-83-5189.64 g/mol

Open in Covalent MOL file
NCl
Aryl halide

Properties

Molecular formula
C11H8ClN
Molar mass
189.64 g/mol
Exact mass
189.0345 Da
logP
3.40Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

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
5969-83-5
SMILES
C1=CC=NC(=C1)C2=CC=C(C=C2)Cl
InChIKey
WHXIEVDMCNQVOV-UHFFFAOYSA-N
InChI
InChI=1S/C11H8ClN/c12-10-6-4-9(5-7-10)11-3-1-2-8-13-11/h1-8H

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Work with 2-(4-Chlorophenyl)pyridine

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-Phenylpyridine1008-89-564 % similar 2,4′-Bipyridine581-47-559 % similar 4-Chloro-2,2'-bipyridine14162-94-859 % similar 2-(4-Methylphenyl)pyridine4467-06-559 % similar 2-(4-Hydroxypenyl)pyridine51035-40-659 % similar 2-(4-Fluorophenyl)pyridine58861-53-359 % similar 2-(4-Bromophenyl)pyriding63996-36-159 % similar 4′-Chloro-2,2′:6′,2′′-terpyridine128143-89-557 % similar

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

Same formula

4-Chloro-2-phenylpyridine57311-18-9

Elsewhere

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