3-(1H-Imidazol-4-yl)benzaldehyde

Base Information

Chemical Name:3-(1H-Imidazol-4-yl)benzaldehyde
CAS No.:179056-81-6
Molecular Formula:C10H8 N2 O
Molecular Weight:172.18
Hs Code.:2933290090
DSSTox Substance ID:DTXSID10440993
Wikidata:Q82257516
ChEMBL ID:CHEMBL507123
Mol file:179056-81-6.mol

Synonyms:3-(1H-Imidazol-4-yl)benzaldehyde;179056-81-6;3-(1H-imidazol-5-yl)benzaldehyde;CHEMBL507123;SCHEMBL1502368;SCHEMBL15653026;BDBM24676;DTXSID10440993;3-(1H-imidazol-4-yl)benzaldehyde, 12;CS-0269097;FT-0707012;EN300-745702;A912011

Suppliers and Price of 3-(1H-Imidazol-4-yl)benzaldehyde

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

Matrix Scientific
3-(1H-Imidazol-4-yl)benzaldehyde 95%
1g
$ 488.00

Crysdot
3-(1H-Imidazol-4-yl)benzaldehyde 95+%
1g
$ 459.00

Chemenu
3-(1H-Imidazol-4-yl)benzaldehyde 95%
1g
$ 434.00

Atlantic Research Chemicals
3-(1H-Imidazol-4-yl)benzaldehyde 95%
1gm:
$ 463.03

American Custom Chemicals Corporation
3-(1H-IMIDAZOL-4-YL)BENZALDEHYDE 95.00%
1G
$ 863.08

Alichem
3-(1H-Imidazol-4-yl)benzaldehyde
1g
$ 491.84

AK Scientific
3-(1H-Imidazol-4-yl)benzaldehyde
1g
$ 708.00

Total 9 raw suppliers

Chemical Property of 3-(1H-Imidazol-4-yl)benzaldehyde

Chemical Property:

PSA：45.75000
LogP:1.88920
Storage Temp.:2-8°C
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:172.063662883
Heavy Atom Count:13
Complexity:184

Purity/Quality:

97% ^*data from raw suppliers

3-(1H-Imidazol-4-yl)benzaldehyde 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)C2=CN=CN2)C=O

Technology Process of 3-(1H-Imidazol-4-yl)benzaldehyde

There total 3 articles about 3-(1H-Imidazol-4-yl)benzaldehyde 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: 74.0%

: 88304-58-9
3-(1H-imidazol-4-yl)benzonitrile

: 179056-81-6
3-(1H-imidazol-4-yl)benzaldehyde

Guidance literature:: With formic acid; Raney nickel (NDT-90); In water; for 3h; Heating;
DOI:10.1021/jm9800853

Reference yield:

: 6136-68-1
3-acethylbenzonitrile

: 179056-81-6
3-(1H-imidazol-4-yl)benzaldehyde

Guidance literature:: Multi-step reaction with 3 steps

1: Br₂ / diethyl ether; dioxane / 0.67 h / Ambient temperature

2: 51 percent / 0.5 h / 185 °C

3: 74 percent / Raney nickel (NDT-90), HCOOH / H₂O / 3 h / Heating

With formic acid; Raney nickel (NDT-90); bromine; In 1,4-dioxane; diethyl ether; water;
DOI:10.1021/jm9800853

Reference yield:

: 50916-55-7
3-(2-bromoacetyl)benzonitrile

: 179056-81-6
3-(1H-imidazol-4-yl)benzaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: 51 percent / 0.5 h / 185 °C

2: 74 percent / Raney nickel (NDT-90), HCOOH / H₂O / 3 h / Heating

With formic acid; Raney nickel (NDT-90); In water;
DOI:10.1021/jm9800853