2-(4-Methylphenyl)pyridine

C₁₂H₁₁NCAS 4467-06-5169.23 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₁N
Molar mass: 169.23 g/mol
Exact mass: 169.0891 Da
Density: 1.055 g/mL (at 25 °C)
Melting point: 132–132.5 °C
Boiling point: 93–98 °C (at 1 Torr)
logP: 3.06Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation89.1% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

4467-06-5

SMILES

Cc1ccc(-c2ccccn2)cc1

InChIKey

KJNZQKYSNAQLEO-UHFFFAOYSA-N

InChI

InChI=1S/C12H11N/c1-10-5-7-11(8-6-10)12-4-2-3-9-13-12/h2-9H,1H3

Weigh it out

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

Names and synonyms

9 names

Pyridine, 2-(4-methylphenyl)-
Pyridine, 2-p-tolyl-
2-(p-Methylphenyl)pyridine
2-p-Tolylpyridine
2-(4-Tolyl)pyridine
4-(2-Pyridinyl)toluene
4-(2-Pyridyl)toluene
2-(4′-Methylphenyl)pyridine
2-(p-Tolyl)pyridine

Work with 2-(4-Methylphenyl)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

4'-(4-Methylphenyl)-2,2'-6',2''-terpyridine89972-77-068 % similar 2-Phenylpyridine1008-89-564 % similar 2,4'-Bipyridine581-47-559 % similar 2-(4-Hydroxypenyl)pyridine51035-40-659 % similar 2-(4-Fluorophenyl)pyridine58861-53-359 % similar 2-(4-Chlorophenyl)pyridine5969-83-559 % similar 2-(4-Bromophenyl)pyriding63996-36-159 % similar 5-Methyl-2-(4-methylphenyl)pyridine85237-71-457 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-(Phenylmethyl)pyridine101-82-6 3-Methyl-2-phenylpyridine10273-90-2 Diphenylamine122-39-4 4-Benzylpyridine2116-65-6 3-Aminobiphenyl2243-47-2 5-Methyl-2-phenylpyridine27012-22-2 4-Methyl-2-phenylpyridine3475-21-6 3-Benzylpyridine620-95-1

Elsewhere

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