4-Cyanobenzoic acid, pentyl ester

Base Information

Chemical Name:4-Cyanobenzoic acid, pentyl ester
CAS No.:54210-46-7
Molecular Formula:C₁₃H₁₅NO₂
Molecular Weight:217.268
Hs Code.:
DSSTox Substance ID:DTXSID701314491

Synonyms:4-Cyanobenzoic acid, pentyl ester;pentyl 4-cyanobenzoate;DTXSID701314491;54210-46-7

Suppliers and Price of 4-Cyanobenzoic acid, pentyl ester

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 0 raw suppliers

Chemical Property of 4-Cyanobenzoic acid, pentyl ester

Chemical Property:

XLogP3:3.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:217.110278721
Heavy Atom Count:16
Complexity:258

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCCOC(=O)C1=CC=C(C=C1)C#N

Technology Process of 4-Cyanobenzoic acid, pentyl ester

There total 2 articles about 4-Cyanobenzoic acid, pentyl ester 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: 57.0%

: 71-41-0
pentan-1-ol

: 17201-43-3
4-cyanobenzyl bromide

: 54210-46-7
pentyl 4-cyanobenzoate

Guidance literature:: With potassium phosphate; oxygen; 1,3-bis[2,6-diisopropylphenyl]imidazolium chloride; In N,N-dimethyl acetamide; at 25 ℃; for 36h; Schlenk technique;
DOI:10.1002/anie.202011039