4-Isothiocyanatobutan-2-one

Base Information Edit

Chemical Name:4-Isothiocyanatobutan-2-one
CAS No.:4868-43-3
Molecular Formula:C5H7NOS
Molecular Weight:129.183
Hs Code.:
DSSTox Substance ID:DTXSID50520965
Nikkaji Number:J1.141.060J
Mol file:4868-43-3.mol

Synonyms:4-isothiocyanatobutan-2-one;4868-43-3;SCHEMBL14489602;DTXSID50520965;EN300-7550589

Suppliers and Price of 4-Isothiocyanatobutan-2-one

Supply Marketing:Edit

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 2 raw suppliers

Chemical Property of 4-Isothiocyanatobutan-2-one Edit

Chemical Property:

XLogP3:1.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:129.02483502
Heavy Atom Count:8
Complexity:126

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

Safty Information:

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MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)CCN=C=S

Technology Process of 4-Isothiocyanatobutan-2-one

There total 3 articles about 4-Isothiocyanatobutan-2-one 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: