3-(4-Chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole

Base Information

Chemical Name:3-(4-Chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole
CAS No.:628737-12-2
Molecular Formula:C15H11ClN2O2S
Molecular Weight:318.784
Hs Code.:
European Community (EC) Number:619-788-8
DSSTox Substance ID:DTXSID90469304
Wikidata:Q82296964

Synonyms:3-(4-Chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole;628737-12-2;SCHEMBL2984548;DTXSID90469304;SHTVHNWTKBEJOB-UHFFFAOYSA-N

Suppliers and Price of 3-(4-Chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole

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 1 raw suppliers

Chemical Property of 3-(4-Chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole

Chemical Property:

XLogP3:5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:318.0229765
Heavy Atom Count:21
Complexity:384

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C2=C(N1)C=CC=C2[N+](=O)[O-])SC3=CC=C(C=C3)Cl

Technology Process of 3-(4-Chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole

There total 4 articles about 3-(4-Chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole 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: 93.0%

: 3484-10-4
2-methyl-4-nitro-1H-indole

: 1142-19-4
4,4'-dichlorodiphenyl disulfide

: 628737-12-2
3-(4-chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole

Guidance literature:: With sodium methylate; In methanol; at 60 - 65 ℃; for 3.5h; Product distribution / selectivity;

Reference yield: 81.0%

: 3484-10-4
2-methyl-4-nitro-1H-indole

: 628737-12-2
3-(4-chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole

Guidance literature:: 4,4'-dichlorodiphenyl disulfide; With trichloroisocyanuric acid; In ethyl acetate; at 20 ℃; for 0.5h;

2-methyl-4-nitro-1H-indole; In ethyl acetate; at 20 ℃; for 0.666667h; Product distribution / selectivity;

Reference yield:

: 25784-83-2
(p-chlorophenylthio)acetone

: 99-09-2
3-nitro-aniline

: 628737-12-2
3-(4-chlorophenylsulfanyl)-2-methyl-4-nitro-1H-indole

Guidance literature:: 3-nitro-aniline; With tert-butylhypochlorite; In tetrahydrofuran; at -78 - -65 ℃; for 0.416667h;

(p-chlorophenylthio)acetone; In tetrahydrofuran; at -65 ℃; for 2h;

With triethylamine; In tetrahydrofuran; at -65 - 20 ℃;