2,3-Dioxoindoline-5-carbonitrile

Base Information

Chemical Name:2,3-Dioxoindoline-5-carbonitrile
CAS No.:61394-92-1
Molecular Formula:C9H4N2O2
Molecular Weight:172.143
Hs Code.:
DSSTox Substance ID:DTXSID20493359
Nikkaji Number:J2.616.247E
Wikidata:Q82339986
Mol file:61394-92-1.mol

Synonyms:2,3-dioxoindoline-5-carbonitrile;61394-92-1;2,3-DIOXO-1H-INDOLE-5-CARBONITRILE;2,3-DIHYDRO-2,3-DIOXO-1H-INDOLE-5-CARBONITRILE;2,3-dioxo-2,3-dihydro-1h-indole-5-carbonitrile;1H-Indole-5-carbonitrile, 2,3-dihydro-2,3-dioxo-;5-cyanoisatin;2,3-dioxo indoline-5-carbonitrile;SCHEMBL2498450;FTNCNIBQOCAFOV-UHFFFAOYSA-;DTXSID20493359;FTNCNIBQOCAFOV-UHFFFAOYSA-N;MFCD09732490;AKOS000141172;BS-45781;CS-0203826;E82450;InChI=1/C9H4N2O2/c10-4-5-1-2-7-6(3-5)8(12)9(13)11-7/h1-3H,(H,11,12,13)

Suppliers and Price of 2,3-Dioxoindoline-5-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
2,3-DIHYDRO-2,3-DIOXO-1H-INDOLE-5-CARBONITRILE 95.00%
5MG
$ 499.54

AccelPharmtech
2,3-dihydro-2,3-dioxo-1H-Indole-5-carbonitrile 97.00%
25G
$ 5120.00

AccelPharmtech
2,3-dihydro-2,3-dioxo-1H-Indole-5-carbonitrile 97.00%
5G
$ 2750.00

Total 10 raw suppliers

Chemical Property of 2,3-Dioxoindoline-5-carbonitrile

Chemical Property:

Melting Point:270-272 °C (decomp)
PKA:8.33±0.20(Predicted)
PSA：69.96000
Density:1.48±0.1 g/cm3(Predicted)
LogP:0.83108
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:0
Exact Mass:172.027277375
Heavy Atom Count:13
Complexity:315

Purity/Quality:

97% ^*data from raw suppliers

2,3-DIHYDRO-2,3-DIOXO-1H-INDOLE-5-CARBONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC2=C(C=C1C#N)C(=O)C(=O)N2

Technology Process of 2,3-Dioxoindoline-5-carbonitrile

There total 6 articles about 2,3-Dioxoindoline-5-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: 99.0%

: 2-(2-amino-5-cyanophenyl)-N-hexyl-2-oxoacetamide

: 61394-92-1
2, 3-dioxoindoline-5-carbonitrile

Guidance literature:: With hydrogenchloride; In tetrahydrofuran; water; at 60 ℃;
DOI:10.1002/ejoc.201600143

Reference yield: 93.0%

: 1092114-59-4
3-iodo-1H-indole-5-carbonitrile

: 61394-92-1
2, 3-dioxoindoline-5-carbonitrile

Guidance literature:: With N-iodo-succinimide; 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione; In dimethyl sulfoxide; at 25 - 35 ℃; for 4h;
DOI:10.1016/j.tet.2019.02.033