2-pyridin-4-yl-1H-imidazole-5-carbaldehyde

Base Information

Chemical Name:2-pyridin-4-yl-1H-imidazole-5-carbaldehyde
CAS No.:279251-10-4
Molecular Formula:C₉H₇N₃O
Molecular Weight:173.174
Hs Code.:2933990090
DSSTox Substance ID:DTXSID70442019
Wikidata:Q82259070
Mol file:279251-10-4.mol

Synonyms:279251-10-4;SCHEMBL8327153;DTXSID70442019;AKOS013433587;AG-E-89247

Suppliers and Price of 2-pyridin-4-yl-1H-imidazole-5-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

American Custom Chemicals Corporation
2-PYRIDIN-4-YL-1H-IMIDAZOLE-4-CARBALDEHYDE 95.00%
5MG
$ 495.17

Abosyn
2-(pyridin-4-yl)-1H-imidazole-5-carbaldehyde 95%-98%
1g
$ 712.00

Total 1 raw suppliers

Chemical Property of 2-pyridin-4-yl-1H-imidazole-5-carbaldehyde

Chemical Property:

Melting Point:204 °C
Boiling Point:474.4±25.0 °C(Predicted)
PKA:9.28±0.10(Predicted)
PSA：58.64000
Density:1.320±0.06 g/cm3(Predicted)
LogP:1.28420
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:173.058911855
Heavy Atom Count:13
Complexity:180

Purity/Quality:: 2-PYRIDIN-4-YL-1H-IMIDAZOLE-4-CARBALDEHYDE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CN=CC=C1C2=NC=C(N2)C=O

Technology Process of 2-pyridin-4-yl-1H-imidazole-5-carbaldehyde

There total 2 articles about 2-pyridin-4-yl-1H-imidazole-5-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: 55.0%

: 34626-11-4
2-(4-pyridyl)-1H-imidazole-4-carbonitrile

: 279251-10-4
2-(4-pyridyl)-1H-imidazole-4-carbaldehyde

Guidance literature:: With diisobutylaluminium hydride; In tetrahydrofuran; toluene; at -78 - 0 ℃;
DOI:10.1021/jm991154w

Reference yield:

: 33468-83-6
4-(4-(trifluoromethyl)-1H-imidazol-2-yl)pyridine

: 279251-10-4
2-(4-pyridyl)-1H-imidazole-4-carbaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: 84 percent / aq. NH₃ / methanol / 24 h / 60 °C

2: 55 percent / DIBALH / tetrahydrofuran; toluene / -78 - 0 °C

With ammonium hydroxide; diisobutylaluminium hydride; In tetrahydrofuran; methanol; toluene; 1: Substitution / 2: Reduction;
DOI:10.1021/jm991154w

Reference yield:

: 279251-10-4
2-(4-pyridyl)-1H-imidazole-4-carbaldehyde

: 4-(4-(chloromethyl)-1H-imidazol-2-yl)pyridine hydrochloride

Guidance literature:: Multi-step reaction with 2 steps

1: sodium tetrahydroborate / methanol / 0.33 h / 0 - 20 °C

2: thionyl chloride / 0.5 h / 0 - 20 °C

With sodium tetrahydroborate; thionyl chloride; In methanol;
DOI:10.1021/acs.jmedchem.7b00443