2-Fluorobenzoyl isothiocyanate

Base Information

Chemical Name:2-Fluorobenzoyl isothiocyanate
CAS No.:73945-65-0
Molecular Formula:C8H4FNOS
Molecular Weight:181.19
Hs Code.:
European Community (EC) Number:824-147-2
DSSTox Substance ID:DTXSID20576333

Synonyms:2-fluorobenzoyl isothiocyanate;73945-65-0;Benzoyl isothiocyanate, 2-fluoro-;fluorobenzoyl isothiocyanate;2-fluorobenzoylisothiocyanate;SCHEMBL5825234;DTXSID20576333;SPRXMLIDSAYUFL-UHFFFAOYSA-N;AKOS009075020;2-Fluoro-1-benzenecarbonyl isothiocyanate;EN300-21907

Suppliers and Price of 2-Fluorobenzoyl isothiocyanate

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 3 raw suppliers

Chemical Property of 2-Fluorobenzoyl isothiocyanate

Chemical Property:

PSA：61.52000
LogP:2.06870
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:180.99976309
Heavy Atom Count:12
Complexity:225

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C(=C1)C(=O)N=C=S)F

Technology Process of 2-Fluorobenzoyl isothiocyanate

There total 7 articles about 2-Fluorobenzoyl isothiocyanate 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:

: 1147550-11-5
ammonium thiocyanate

: 393-52-2
2-Fluorobenzoyl chloride

: 73945-65-0
2-fluorobenzoyl isothiocyanate

Guidance literature:: With polyethylene glycol-400; In dichloromethane; at 20 ℃; for 1h;
DOI:10.1081/SCC-120021977

Reference yield:

: 333-20-0
potassium thioacyanate

: 393-52-2
2-Fluorobenzoyl chloride

: 73945-65-0
2-fluorobenzoyl isothiocyanate

Guidance literature:: In acetone; at 50 ℃;
DOI:10.1016/j.jfluchem.2009.02.009

Reference yield:

: 1147550-11-5
ammonium thiocyanate

: 445-29-4
o-fluoro-benzoic acid

: 73945-65-0
2-fluorobenzoyl isothiocyanate

Guidance literature:: o-fluoro-benzoic acid; With thionyl chloride; N,N-dimethyl-formamide; for 2h; Reflux;

ammonium thiocyanate; In acetone; at 40 ℃; for 0.0833333h;
DOI:10.1016/j.bmc.2015.02.033