3-(Methylthio)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile

Base Information

Chemical Name:3-(Methylthio)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile
CAS No.:168279-53-6
Molecular Formula:C₁₀H₉NOS₂
Molecular Weight:223.32
Hs Code.:
DSSTox Substance ID:DTXSID30381112
Nikkaji Number:J662.586J
Wikidata:Q82171742
Mol file:168279-53-6.mol

Synonyms:168279-53-6;3-(methylthio)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile;3-methylsulfanyl-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carbonitrile;3-(Methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carbonitrile;Benzo[c]thiophene-1-carbonitrile, 4,5,6,7-tetrahydro-3-(methylthio)-4-oxo-;Maybridge1_004476;NIOBIUMTELLURIDE;SCHEMBL2434846;HMS554D10;DTXSID30381112;MFCD00084985;AKOS015908680;FT-0613809;1-Cyano-3-(methylthio)-4,5,6,7-tetrahydrobenzo(c)thiophen-4-one;3-(Methyl thio)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile;3-methylsulfanyl-4-oxo-4,5,6,7-tetrahydro-benzo[c]thiophene-1-carbonitrile;4,5,6,7-Tetrahydro-3-methylthio-4-oxobenzo[c]thiophene-1-carbonitrile;3-(methylsulfanyl)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile;3-(methylthio)-4-oxo-4,5,6,7-tetrahydro-2-benzo[b]thiophene-1-carbonitrile

Suppliers and Price of 3-(Methylthio)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile

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

American Custom Chemicals Corporation
3-(METHYLTHIO)-4-OXO-4,5,6,7-TETRAHYDRO-2-BENZOTHIOPHENE-1-CARBONITRILE 95.00%
5MG
$ 504.76

Total 4 raw suppliers

Chemical Property of 3-(Methylthio)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile

Chemical Property:

Vapor Pressure:1.67E-06mmHg at 25°C
Melting Point:151-154oC
Boiling Point:396.7oC at 760 mmHg
Flash Point:193.7oC
PSA：94.40000
Density:1.36g/cm3
LogP:2.86068
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:223.01255626
Heavy Atom Count:14
Complexity:296

Purity/Quality:

99% ^*data from raw suppliers

3-(METHYLTHIO)-4-OXO-4,5,6,7-TETRAHYDRO-2-BENZOTHIOPHENE-1-CARBONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 36/37/38
Safety Statements: 26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=C2C(=C(S1)C#N)CCCC2=O

Technology Process of 3-(Methylthio)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile

There total 1 articles about 3-(Methylthio)-4-oxo-4,5,6,7-tetrahydro-2-benzothiophene-1-carbonitrile 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: