(S)-1,2,3,3A-Tetrahydropyrrolo[1,2-A]quinoxalin-4(5H)-one

Base Information

Chemical Name:(S)-1,2,3,3A-Tetrahydropyrrolo[1,2-A]quinoxalin-4(5H)-one
CAS No.:214143-78-9
Molecular Formula:C₁₁H₁₂N₂O
Molecular Weight:188.229
Hs Code.:2933990090
DSSTox Substance ID:DTXSID60354359
Wikidata:Q82132444
Mol file:214143-78-9.mol

Synonyms:214143-78-9;(S)-1,2,3,3A-TETRAHYDROPYRROLO[1,2-A]QUINOXALIN-4(5H)-ONE;ZINC00251459;SCHEMBL7968278;DTXSID60354359;GWPNDQCLPKQEPD-JTQLQIEISA-N;AKOS006320505;(3aS)-1,2,3,3a,4,5-Hexahydro-Pyrrolo[1,2-a]Quinoxalin-4-One;Pyrrolo[1,2-a]quinoxalin-4(5H)-one,1,2,3,3a-tetrahydro-,(3as)-(9ci)

Suppliers and Price of (S)-1,2,3,3A-Tetrahydropyrrolo[1,2-A]quinoxalin-4(5H)-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

Crysdot
(S)-1,2,3,3A-tetrahydropyrrolo[1,2-a]quinoxalin-4(5H)-one 95+%
1g
$ 704.00

Total 2 raw suppliers

Chemical Property of (S)-1,2,3,3A-Tetrahydropyrrolo[1,2-A]quinoxalin-4(5H)-one

Chemical Property:

PSA：35.83000
LogP:1.75760
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:188.094963011
Heavy Atom Count:14
Complexity:254

Purity/Quality:

97% ^*data from raw suppliers

(S)-1,2,3,3A-tetrahydropyrrolo[1,2-a]quinoxalin-4(5H)-one 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC2C(=O)NC3=CC=CC=C3N2C1
Isomeric SMILES:C1C[C@H]2C(=O)NC3=CC=CC=C3N2C1

Technology Process of (S)-1,2,3,3A-Tetrahydropyrrolo[1,2-A]quinoxalin-4(5H)-one

There total 6 articles about (S)-1,2,3,3A-Tetrahydropyrrolo[1,2-A]quinoxalin-4(5H)-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: 84.0%

: methyl 2-[(2S)-1-(2-nitrophenyl)pyrrolidin-2-yl]acetate

: 214143-78-9
(S)-1,2,3,3a-tetrahydro-5H-pyrrolo[1,2-a]quinoxalin-4-one

Guidance literature:: With hydrogen; palladium on activated charcoal; In ethanol; at 30 ℃; under 20 Torr;
DOI:10.1002/ejoc.200300028

Reference yield: 83.3%

: 31981-54-1
(S)-N-(2-nitrophenyl)proline

: 214143-78-9
(S)-1,2,3,3a-tetrahydro-5H-pyrrolo[1,2-a]quinoxalin-4-one

Guidance literature:: In methanol; palladium-carbon catalyst;

Reference yield: 59.0%

: 615-36-1
2-bromoaniline

: 147-85-3,25191-13-3,37159-97-0,4305-67-3,4607-28-7
L-proline

: 214143-78-9
(S)-1,2,3,3a-tetrahydro-5H-pyrrolo[1,2-a]quinoxalin-4-one

Guidance literature:: With potassium phosphate; copper(l) chloride; N,N`-dimethylethylenediamine; In dimethyl sulfoxide; at 110 ℃; for 24h; Inert atmosphere; Sealed tube;
DOI:10.1002/adsc.201000323