1-Cyanoethyl benzoate

Base Information

Chemical Name:1-Cyanoethyl benzoate
CAS No.:3478-24-8
Molecular Formula:C10H9NO2
Molecular Weight:175.184
Hs Code.:
NSC Number:142045
DSSTox Substance ID:DTXSID10301252
Nikkaji Number:J325.271J
ChEMBL ID:CHEMBL4520984
Mol file:3478-24-8.mol

Synonyms:1-cyanoethyl benzoate;3478-24-8;1-cyanoethylbenzoate;NSC142045;SCHEMBL1344032;CHEMBL4520984;DTXSID10301252;AKOS023429580;NSC-142045;CS-0222553;EN300-111620;Z19825292

Suppliers and Price of 1-Cyanoethyl benzoate

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 6 raw suppliers

Chemical Property of 1-Cyanoethyl benzoate

Chemical Property:

Vapor Pressure:0.000331mmHg at 25°C
Boiling Point:319.8°C at 760 mmHg
Flash Point:149.8°C
Density:1.136g/cm³
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:175.063328530
Heavy Atom Count:13
Complexity:222

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 1-Cyanoethyl benzoate

There total 15 articles about 1-Cyanoethyl benzoate 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: 96.0%

: 98-88-4
benzoyl chloride

: 78-97-7
2-hydroxy-propionitrile

: 98777-16-3,3478-24-8
2-benzoyloxy-1-butyronitrile

Guidance literature:: In pyridine; at 20 ℃; for 2h;
DOI:10.1016/S0957-4166(02)00121-0

Reference yield: 88.0%

: 60011-15-6
2-(benzoyloxy)propanoic acid

: 98777-16-3,3478-24-8
2-benzoyloxy-1-butyronitrile

Guidance literature:: With ammonium carbonate; diphosphorus tetraiodide; In carbon disulfide; at 20 ℃; for 8h;
DOI:10.1016/j.tetlet.2007.06.108