2-Pyridinecarbonitrile, 4-methoxy-3,5-dimethyl-

Base Information

• Chemical Name: 2-Pyridinecarbonitrile, 4-methoxy-3,5-dimethyl-
• CAS No.: 104916-41-8
• Molecular Formula: C9H10N2O
• Molecular Weight: 162.191
• DSSTox Substance ID: DTXSID40454184
• Nikkaji Number: J795.444A
• Wikidata: Q82275551
• Mol file: 104916-41-8.mol

Synonyms:104916-41-8;2-Pyridinecarbonitrile, 4-methoxy-3,5-dimethyl-;4-Methoxy-3,5-dimethylpicolinonitrile;4-METHOXY-3,5-DIMETHYLPYRIDINE-2-CARBONITRILE;SCHEMBL7672194;DTXSID40454184;KUUHFNGGLJKJIZ-UHFFFAOYSA-N;3,5-dimethyl-4-methoxy-2-cyanopyridine;CS-0377335;3,5-Dimethyl-4-methoxy-2-pyridinecarbonitrile

Chemical Property of 2-Pyridinecarbonitrile, 4-methoxy-3,5-dimethyl-

Chemical Property:

• PSA: 45.91000
• LogP: 1.57868
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 162.079312947
• Heavy Atom Count: 12
• Complexity: 196

Purity/Quality:

4-Methoxy-3,5-dimethylpicolinonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CN=C(C(=C1OC)C)C#N
• Uses: 4-Methoxy-3,5-dimethylpicolinonitrile has been used as a reactant in the synthesis of 2-[(3,5-dimethyl-4-methoxypyridinyl)alkyl]benzothiazolidine derivatives as gastric H+/K+-ATPase inhibitor1.

Technology Process of 2-Pyridinecarbonitrile, 4-methoxy-3,5-dimethyl-

There total 10 articles about 2-Pyridinecarbonitrile, 4-methoxy-3,5-dimethyl- 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: 91.0%

2-Carboxamide-3,5-Dimethyl-4-Methoxypyridine (187222-21-5) → 3,5-dimethyl-4-methoxy-2-cyanopyridine (104916-41-8)

Guidance literature:

With pyridine; trifluoroacetic anhydride; In dichloromethane; Ambient temperature;

DOI:10.3987/COM-96-7617

Reference yield:

1-hydroxy-2-methyl-1-penten-3-one (50421-81-3) → 3,5-dimethyl-4-methoxy-2-cyanopyridine (104916-41-8)

Guidance literature:

Multi-step reaction with 6 steps

1: 84 percent / anh. potassium carbonate / acetone / 34 h / Heating

2: 20 percent / sodium ethoxide / ethanol / 0.5 h / Heating

3: 92 percent / sulfuric acid / 4 h / Heating

4: 91 percent / ammonia / ethanol / 48 h / 120 °C

5: 90 percent / anh. potassium carbonate / acetone / 15 h / Heating

6: 91 percent / pyridine, trifluoroacetic anhydride / CH₂Cl₂ / Ambient temperature

With pyridine; sulfuric acid; ammonia; sodium ethanolate; potassium carbonate; trifluoroacetic anhydride; In ethanol; dichloromethane; acetone;

DOI:10.3987/COM-96-7617

Reference yield:

1-ethoxy-2-methylpent-1-en-3-one (187222-11-3) → 3,5-dimethyl-4-methoxy-2-cyanopyridine (104916-41-8)

Guidance literature:

Multi-step reaction with 5 steps

1: 20 percent / sodium ethoxide / ethanol / 0.5 h / Heating

2: 92 percent / sulfuric acid / 4 h / Heating

3: 91 percent / ammonia / ethanol / 48 h / 120 °C

4: 90 percent / anh. potassium carbonate / acetone / 15 h / Heating

5: 91 percent / pyridine, trifluoroacetic anhydride / CH₂Cl₂ / Ambient temperature

With pyridine; sulfuric acid; ammonia; sodium ethanolate; potassium carbonate; trifluoroacetic anhydride; In ethanol; dichloromethane; acetone;

DOI:10.3987/COM-96-7617

upstream raw materials:

2-Carboxamide-3,5-Dimethyl-4-Methoxypyridine

1-hydroxy-2-methyl-1-penten-3-one

1-ethoxy-2-methylpent-1-en-3-one

3,5-dimethyl-4-oxo-4H-pyran-2-carboxylic acid

Downstream raw materials:

2-(chloromethyl)-4-methoxy-3,5-dimethylpyridine hydrochloride

(4-methoxy-3,5-dimethylpyridin-2-yl)methanamine

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 104916-41-8 4-Methoxy-3,5-diMethylpicolinonitrile

Send

Send

Metric Ton KG G Pound L ML

Send

Send