2,3-Dihydro-1H-indolizino[6,7-b]indol-5(6H)-one

Base Information

Chemical Name:2,3-Dihydro-1H-indolizino[6,7-b]indol-5(6H)-one
CAS No.:612065-16-4
Molecular Formula:C₁₄H₁₂N₂O
Molecular Weight:224.262
Hs Code.:
DSSTox Substance ID:DTXSID10460919
Nikkaji Number:J1.976.575J
Wikidata:Q82285097
Mol file:612065-16-4.mol

Synonyms:612065-16-4;2,3-Dihydro-1H-indolizino[6,7-b]indol-5(6H)-one;5H-Indolizino[6,7-b]indol-5-one,1,2,3,6-tetrahydro-;DTXSID10460919;4-Chloro-2-(trifluoromethyl)phenylaceticacid;1,2,3,6-Tetrahydro-5H-indolizino[6,7-b]indol-5-one

Suppliers and Price of 2,3-Dihydro-1H-indolizino[6,7-b]indol-5(6H)-one

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
1,2,3,6-TETRAHYDROINDOLIZINO[6,7-B]INDOL-5-ONE 95.00%
5MG
$ 498.76

Total 2 raw suppliers

Chemical Property of 2,3-Dihydro-1H-indolizino[6,7-b]indol-5(6H)-one

Chemical Property:

Vapor Pressure:1.4E-10mmHg at 25°C
Boiling Point:511.6°C at 760 mmHg
Flash Point:263.2°C
PSA：37.79000
Density:1.39g/cm³
LogP:2.42900
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:224.094963011
Heavy Atom Count:17
Complexity:390

Purity/Quality:: 1,2,3,6-TETRAHYDROINDOLIZINO[6,7-B]INDOL-5-ONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC2=CC3=C(C(=O)N2C1)NC4=CC=CC=C43

Technology Process of 2,3-Dihydro-1H-indolizino[6,7-b]indol-5(6H)-one

There total 6 articles about 2,3-Dihydro-1H-indolizino[6,7-b]indol-5(6H)-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: 65.0%

: 612065-11-9
6-(2-bromo-phenylamino)-2,3-dihydro-1H-indolizin-5-one

: 612065-16-4
1,2,3,6-tetrahydroindolizino[6,7-b]indol-5-one

Guidance literature:: With caesium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,4-dioxane; at 110 ℃; for 24h;
DOI:10.1021/ol0356338

Reference yield:

: 612065-04-0
trifluoro-methanesulfonic acid 5-oxo-1,2,3,5-tetrahydro-indolizin-6-yl ester

: 612065-16-4
1,2,3,6-tetrahydroindolizino[6,7-b]indol-5-one

Guidance literature:: Multi-step reaction with 2 steps

1: 80 percent / 9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene; cesium carbonate / tris(dibenzylideneacetone)palladium⁽⁰⁾ / dioxane / 100 °C

2: 65 percent / Cs₂CO₃ / Pd(PPh₃)4 / dioxane / 24 h / 110 °C

With caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,4-dioxane; 2: intramolecular Heck reaction;
DOI:10.1021/jo0511492

Reference yield:

: 615-36-1
2-bromoaniline

: 612065-16-4
1,2,3,6-tetrahydroindolizino[6,7-b]indol-5-one

Guidance literature:: Multi-step reaction with 2 steps

1: 80 percent / Xantphos; Cs₂CO₃ / tris(dibenzylideneacetone)dipalladium⁽⁰⁾ / dioxane / 100 °C

2: 65 percent / Cs₂CO₃ / Pd(PPh₃)4 / dioxane / 24 h / 110 °C

With caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In 1,4-dioxane; 2: Heck reaction;
DOI:10.1021/ol0356338