p-(Cyanovinyl)benzoic acid

Base Information

Chemical Name:p-(Cyanovinyl)benzoic acid
CAS No.:54718-86-4
Molecular Formula:C10H7NO2
Molecular Weight:173.1681
Hs Code.:
European Community (EC) Number:822-459-3
Nikkaji Number:J3.397.043I
Wikidata:Q76323699

Synonyms:p-(Cyanovinyl)benzoic acid;Benzoic acid, p-(cyanovinyl)-;54718-86-4;SCHEMBL10458610;HMS1538D06;AKOS005158618;NCGC00174385-01;LS-36677

Suppliers and Price of p-(Cyanovinyl)benzoic acid

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 1 raw suppliers

Chemical Property of p-(Cyanovinyl)benzoic acid

Chemical Property:

Vapor Pressure:6.03E-07mmHg at 25°C
Boiling Point:394.9°Cat760mmHg
Flash Point:192.6°C
PSA：61.09000
Density:1.27g/cm³
LogP:1.92158
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:173.047678466
Heavy Atom Count:13
Complexity:253

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C=CC#N)C(=O)O
Isomeric SMILES:C1=CC(=CC=C1/C=C/C#N)C(=O)O

Technology Process of p-(Cyanovinyl)benzoic acid

There total 3 articles about p-(Cyanovinyl)benzoic acid 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:

: 55583-99-8,63456-21-3,63456-22-4
α-Chloro-p-carboxyhydrocinnamonitrile

: 54718-86-4
4-(2-cyanovinyl)benzoic acid

Guidance literature:: With triethylamine; for 6h; Yield given; Heating;
DOI:10.1007/BF00765769

Reference yield:

: 150-13-0,159246-81-8,8014-65-1
4-amino-benzoic acid

: 54718-86-4
4-(2-cyanovinyl)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) 18 percent aq. HCl, NaNO₂, 2.) cupric chloride / 1.) 5 deg C, 2.) acetone, 25 deg C, 3 h; overnight

2: triethylamine / 6 h / Heating

With hydrogenchloride; triethylamine; copper dichloride; sodium nitrite;
DOI:10.1007/BF00765769