1-(2-Methoxyphenyl)-3-oxocyclopentanecarbonitrile

Base Information

Chemical Name:1-(2-Methoxyphenyl)-3-oxocyclopentanecarbonitrile
CAS No.:84409-27-8
Molecular Formula:C₁₃H₁₃NO₂
Molecular Weight:215.252
Hs Code.:
DSSTox Substance ID:DTXSID401233361

Synonyms:1-(2-Methoxyphenyl)-3-oxocyclopentanecarbonitrile;DTXSID401233361;84409-27-8

Suppliers and Price of 1-(2-Methoxyphenyl)-3-oxocyclopentanecarbonitrile

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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-(2-Methoxyphenyl)-3-oxocyclopentanecarbonitrile

Chemical Property:

XLogP3:1.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:215.094628657
Heavy Atom Count:16
Complexity:330

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=CC=CC=C1C2(CCC(=O)C2)C#N

Technology Process of 1-(2-Methoxyphenyl)-3-oxocyclopentanecarbonitrile

There total 4 articles about 1-(2-Methoxyphenyl)-3-oxocyclopentanecarbonitrile 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: 58.0%

: 84409-22-3
4-Cyano-4-(2-methoxy-phenyl)-2-oxo-cyclopentanecarboxylic acid tert-butyl ester

: 84409-27-8
1-(2-Methoxy-phenyl)-3-oxo-cyclopentanecarbonitrile

Guidance literature:: With toluene-4-sulfonic acid; In benzene; Heating;

Reference yield:

: 7035-03-2
2-methoxy-benzeneacetonitrile

: 84409-27-8
1-(2-Methoxy-phenyl)-3-oxo-cyclopentanecarbonitrile

Guidance literature:: Multi-step reaction with 4 steps

1: 95 percent / aq.sodium hydroxide (40 percent), triethylbenzylammonium chloride / 2 h / 40 - 45 °C

2: 72 percent / sodium (powdered) / benzene / 2.5 h / Heating; other reagent (sodium amide)

3: 58 percent / p-toluenesulfonic acid / benzene / Heating

With sodium hydroxide; N-benzyl-N,N,N-triethylammonium chloride; sodium; toluene-4-sulfonic acid; In benzene;

Reference yield:

: 84409-12-1
(+/-)-tert-butyl 3-cyano-3-(2-methoxyphenyl)propanoate

: 84409-27-8
1-(2-Methoxy-phenyl)-3-oxo-cyclopentanecarbonitrile

Guidance literature:: Multi-step reaction with 3 steps

1: 95 percent / aq.sodium hydroxide (40 percent), triethylbenzylammonium chloride / 2 h / 40 - 45 °C

2: 72 percent / sodium (powdered) / benzene / 2.5 h / Heating; other reagent (sodium amide)

3: 58 percent / p-toluenesulfonic acid / benzene / Heating

With sodium hydroxide; N-benzyl-N,N,N-triethylammonium chloride; sodium; toluene-4-sulfonic acid; In benzene;