1-(1-Benzyl-4-chloro-1H-pyrrolo[3,2-c]pyridin-2-yl)ethan-1-one

Base Information

Chemical Name:1-(1-Benzyl-4-chloro-1H-pyrrolo[3,2-c]pyridin-2-yl)ethan-1-one
CAS No.:106689-63-8
Molecular Formula:C16H13ClN2O
Molecular Weight:284.745
Hs Code.:
DSSTox Substance ID:DTXSID00545042
Wikidata:Q82422405

Synonyms:106689-63-8;DTXSID00545042;1-(1-Benzyl-4-chloro-1H-pyrrolo[3,2-c]pyridin-2-yl)ethan-1-one

Suppliers and Price of 1-(1-Benzyl-4-chloro-1H-pyrrolo[3,2-c]pyridin-2-yl)ethan-1-one

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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 1-(1-Benzyl-4-chloro-1H-pyrrolo[3,2-c]pyridin-2-yl)ethan-1-one

Chemical Property:

XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:284.0716407
Heavy Atom Count:20
Complexity:356

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C1=CC2=C(N1CC3=CC=CC=C3)C=CN=C2Cl

Technology Process of 1-(1-Benzyl-4-chloro-1H-pyrrolo[3,2-c]pyridin-2-yl)ethan-1-one

There total 2 articles about 1-(1-Benzyl-4-chloro-1H-pyrrolo[3,2-c]pyridin-2-yl)ethan-1-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: 76.6%

: 106689-62-7
benzyl-1 (α-hydroxyethyl)-2 chloro-4-1H-pyrrolo<3,2-c>pyridine

: 106689-63-8
benzyl-1 acetyl-2 chloro-4-1H-pyrrolo<3,2-c>pyridine

Guidance literature:: With manganese(IV) oxide; In chloroform; for 20h; Heating;
DOI:10.1016/S0040-4020(01)90611-8

Reference yield:

: 35636-10-3
benzyl-1 chloro-4 pyrrolo<3,2-c>pyridine

: 106689-63-8
benzyl-1 acetyl-2 chloro-4-1H-pyrrolo<3,2-c>pyridine

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) t-butyl-lithium / 1.) ether, -65 deg C, 20 min, 2.) -65 dg C, 30 min then rt overnight

2: 76.6 percent / MnO₂ / CHCl₃ / 20 h / Heating

With manganese(IV) oxide; tert.-butyl lithium; In chloroform;
DOI:10.1016/S0040-4020(01)90611-8

Reference yield:

: 106689-63-8
benzyl-1 acetyl-2 chloro-4-1H-pyrrolo<3,2-c>pyridine

: 106689-70-7,106689-71-8
acide β-(benzyl-1 chloro-4-1H-pyrrolo<3,2-c>pyridyl-2)crotonique

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) NaH / 1.) DME, 0 deg C, 3 h, 2.) rt. 48 h

2: KOH / ethanol; H₂O

With potassium hydroxide; sodium hydride; In ethanol; water;
DOI:10.1016/S0040-4020(01)90611-8