2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Base Information

Chemical Name:2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CAS No.:306935-92-2
Molecular Formula:C₁₁H₉F₃N₂S
Molecular Weight:258.267
Hs Code.:2933499090
DSSTox Substance ID:DTXSID50380167
Wikidata:Q82170266
Mol file:306935-92-2.mol

Synonyms:306935-92-2;2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile;2-sulfanylidene-4-(trifluoromethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile;5,6,7,8-Tetrahydro-2-thio-4-(trifluoromethyl)quinoline-3-carbonitrile;2-sulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile;DTXSID50380167;HMS1787G13;2,4-Diamino Phenoxyethanol Sulfate;MFCD02180672;AKOS000268235;PS-7384;CS-0327992;FT-0612741;SR-01000029622;SR-01000029622-1;2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydro quinoline-3-carbonitrile;2-sulfanylidene-4-(trifluoromethyl)-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile

Suppliers and Price of 2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-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

SynQuest Laboratories
5,6,7,8-Tetrahydro-2-thio-4-(trifluoromethyl)quinoline-3-carbonitrile
250 mg
$ 71.00

Matrix Scientific
2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
1g
$ 126.00

Crysdot
2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile 97%
5g
$ 356.00

Apolloscientific
5,6,7,8-Tetrahydro-2-thio-4-(trifluoromethyl)quinoline-3-carbonitrile
250mg
$ 44.00

American Custom Chemicals Corporation
2-MERCAPTO-4-(TRIFLUOROMETHYL)-5,6,7,8-TETRAHYDROQUINOLINE-3-CARBONITRILE 95.00%
250MG
$ 621.16

AK Scientific
2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
1g
$ 220.00

Total 6 raw suppliers

Chemical Property of 2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Chemical Property:

Vapor Pressure:0.000418mmHg at 25°C
Melting Point:216 °C
Refractive Index:1.561
Boiling Point:316.2°Cat760mmHg
PKA:7.32±0.60(Predicted)
Flash Point:145°C
PSA：75.48000
Density:1.42g/cm³
LogP:3.13958
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:0
Exact Mass:258.04385396
Heavy Atom Count:17
Complexity:491

Purity/Quality:

99%, ^*data from raw suppliers

5,6,7,8-Tetrahydro-2-thio-4-(trifluoromethyl)quinoline-3-carbonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 20/21/22-36/37/38
Safety Statements: 26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC2=C(C1)C(=C(C(=S)N2)C#N)C(F)(F)F

Technology Process of 2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile

There total 1 articles about 2-Mercapto-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-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:

: 7357-70-2
Cyanothioacetamide

: 75-90-1
2,2,2-Trifluoroacetaldehyde

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 306935-92-2
C₁₁H₉F₃N₂S

Guidance literature:: 2,2,2-Trifluoroacetaldehyde; cyclohexanone; With potassium hydroxide; In methanol;

Cyanothioacetamide; In methanol;
DOI:10.1016/j.bmc.2016.11.041