6-(4-Methylbenzoyl)pyridine-2-carbaldehyde

Base Information

Chemical Name:6-(4-Methylbenzoyl)pyridine-2-carbaldehyde
CAS No.:94071-17-7
Molecular Formula:C14H11 N O2
Molecular Weight:225.247
Hs Code.:
European Community (EC) Number:301-817-8
UNII:85G7CKW372
DSSTox Substance ID:DTXSID30240376
Nikkaji Number:J368.002I
Wikidata:Q83123207
Mol file:94071-17-7.mol

Synonyms:6-(4-Methylbenzoyl)pyridine-2-carbaldehyde;94071-17-7;EINECS 301-817-8;DTXSID30240376;85G7CKW372;6-(4-Methylbenzoyl)-2-pyridinecarbaldehyde;6-(4-Methylbenzoyl)-2-pyridinecarboxaldehyde;2-Pyridinecarboxaldehyde, 6-(4-methylbenzoyl)-

Suppliers and Price of 6-(4-Methylbenzoyl)pyridine-2-carbaldehyde

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of 6-(4-Methylbenzoyl)pyridine-2-carbaldehyde

Chemical Property:

Vapor Pressure:8.01E-07mmHg at 25°C
Boiling Point:406.6°C at 760 mmHg
Flash Point:201.9°C
PSA：47.03000
Density:1.193g/cm³
LogP:2.43350
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:225.078978594
Heavy Atom Count:17
Complexity:282

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)C(=O)C2=CC=CC(=N2)C=O

Technology Process of 6-(4-Methylbenzoyl)pyridine-2-carbaldehyde

There total 3 articles about 6-(4-Methylbenzoyl)pyridine-2-carbaldehyde which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 62.0%

: 112498-15-4
6-(4-methylbenzyl)-2-methylpyridine

: 94071-17-7
6-(4-methylbenzoyl)pyridine-2-carbaldehyde

Guidance literature:: With copper(l) iodide; oxygen; acetic acid; In dimethyl sulfoxide; at 130 ℃; for 24h; chemoselective reaction;
DOI:10.1002/anie.201108540

Reference yield:

: 108-48-5
2,6-dimethylpyridine

: 94071-17-7
6-(4-methylbenzoyl)pyridine-2-carbaldehyde

Guidance literature:: Multi-step reaction with 3 steps

1.1: n-butyllithium / tetrahydrofuran; hexane / 1 h / -78 - -50 °C / Inert atmosphere

1.2: 1 h / -50 °C / Inert atmosphere

1.3: Inert atmosphere

2.1: palladium(II) trifluoroacetate; caesium carbonate; tricyclohexylphosphine / o-xylene; toluene / 6 h / Inert atmosphere; Reflux

3.1: copper(l) iodide; oxygen; acetic acid / dimethyl sulfoxide / 24 h / 130 °C

With copper(l) iodide; n-butyllithium; palladium(II) trifluoroacetate; oxygen; caesium carbonate; acetic acid; tricyclohexylphosphine; In tetrahydrofuran; hexane; o-xylene; dimethyl sulfoxide; toluene;
DOI:10.1002/anie.201108540

Reference yield:

: 2,4-dimethyl-3-[(6-methylpyridin-2-yl)methyl]pentan-3-ol

: 94071-17-7
6-(4-methylbenzoyl)pyridine-2-carbaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: palladium(II) trifluoroacetate; caesium carbonate; tricyclohexylphosphine / o-xylene; toluene / 6 h / Inert atmosphere; Reflux

2: copper(l) iodide; oxygen; acetic acid / dimethyl sulfoxide / 24 h / 130 °C

With copper(l) iodide; palladium(II) trifluoroacetate; oxygen; caesium carbonate; acetic acid; tricyclohexylphosphine; In o-xylene; dimethyl sulfoxide; toluene;
DOI:10.1002/anie.201108540