4,7-Dihydro-4-oxo-1-(phenylmethyl)-1H-pyrrolo[2,3-b]pyridine-3,5-dicarboxylic acid

Base Information

Chemical Name:4,7-Dihydro-4-oxo-1-(phenylmethyl)-1H-pyrrolo[2,3-b]pyridine-3,5-dicarboxylic acid
CAS No.:74420-13-6
Molecular Formula:C₁₆H₁₂N₂O₅
Molecular Weight:312.282
Hs Code.:
DSSTox Substance ID:DTXSID201130850

Synonyms:DTXSID201130850;4,7-Dihydro-4-oxo-1-(phenylmethyl)-1H-pyrrolo[2,3-b]pyridine-3,5-dicarboxylic acid;74420-13-6

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 4,7-Dihydro-4-oxo-1-(phenylmethyl)-1H-pyrrolo[2,3-b]pyridine-3,5-dicarboxylic acid

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:312.07462149
Heavy Atom Count:23
Complexity:553

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CN2C=C(C3=C2NC=C(C3=O)C(=O)O)C(=O)O

Technology Process of 4,7-Dihydro-4-oxo-1-(phenylmethyl)-1H-pyrrolo[2,3-b]pyridine-3,5-dicarboxylic acid

There total 1 articles about 4,7-Dihydro-4-oxo-1-(phenylmethyl)-1H-pyrrolo[2,3-b]pyridine-3,5-dicarboxylic acid 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: 100.0%

: 59661-65-3
benzyl-1 cyano-3 oxo-4 dihydro-4,7 pyrrolo<2,3-b>pyridine carboxylate d'ethyle

: 74420-13-6
1-Benzyl-4-oxo-4,7-dihydro-1H-pyrrolo<2,3-b>pyridine-3,5-dicarboxylic acid

Guidance literature:: With sodium hydroxide; for 1.5h; Heating;
DOI:10.1021/jo01308a021

Reference yield: 74.7%

: 74420-13-6
1-Benzyl-4-oxo-4,7-dihydro-1H-pyrrolo<2,3-b>pyridine-3,5-dicarboxylic acid

: 74420-14-7
1-Benzyl-1H-pyrrolo<2,3-b>pyridine-4-ol

Guidance literature:: In diphenylether; for 2h; Heating;
DOI:10.1021/jo01308a021

Reference yield:

: 74420-13-6
1-Benzyl-4-oxo-4,7-dihydro-1H-pyrrolo<2,3-b>pyridine-3,5-dicarboxylic acid

: 74420-04-5
1-Benzyl-4-Chloro-1H-pyrrolo<2,3-b>pyridine

Guidance literature:: Multi-step reaction with 2 steps

1: 74.7 percent / diphenyl ether / 2 h / Heating

2: 33 percent / Phosphorus oxychloride / CHCl₃ / 3 h / 85 - 90 °C

With trichlorophosphate; In diphenylether; chloroform;
DOI:10.1021/jo01308a021