3,5-Dichloroisonicotinoyl chloride

Base Information

• Chemical Name: 3,5-Dichloroisonicotinoyl chloride
• CAS No.: 229328-97-6
• Molecular Formula: C6H2Cl3NO
• Molecular Weight: 210.447
• European Community (EC) Number: 620-988-2
• Nikkaji Number: J1.690.276D
• Mol file: 229328-97-6.mol

Synonyms:3,5-dichloroisonicotinoyl chloride;229328-97-6;3,5-dichloropyridine-4-carbonyl Chloride;4-Pyridinecarbonyl chloride, 3,5-dichloro-;SCHEMBL1666884;3,5-dichloroisonicotinoylchloride;GYEWEUCHJJZGFQ-UHFFFAOYSA-N;3,5 dichloro-isonicotinoylchloride;3,5-dichloro-isonicotinoyl chloride;AKOS028113696;3,5-dichloropyridine-4-carbonylchloride;3, 5-dichloropyridine-4-carbonyl chloride;3,5-Dichloropyridine-4-carboxylic acid chloride;EN300-1459132

Chemical Property of 3,5-Dichloroisonicotinoyl chloride

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 208.920197
• Heavy Atom Count: 11
• Complexity: 154

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=C(C(=C(C=N1)Cl)C(=O)Cl)Cl

Technology Process of 3,5-Dichloroisonicotinoyl chloride

There total 1 articles about 3,5-Dichloroisonicotinoyl chloride 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:

3-(4-aminophenyl)-2-{3-[(2,2-dimethylpropionyl)isobutylamino]-4-methoxyphenyl} propionic acid ethyl ester (400648-63-7) → 3,5-dichloroisonicotinoyl chloride (229328-97-6) + 3-[4-(3,5-dichloropyridine-4-carbonylamino) phenyl]-2-{3-[(2,2-dimethylpropionyl)isobutylamino]-4-methoxyphenyl}propionic acid ethyl ester (400648-65-9)

Guidance literature:

With pyridine; In water; 1,2-dichloro-ethane;

Reference yield: 100.0%

ethyl 4-[(3-nitropyridin-2-yl)amino]-L-phenylalaninate (1031337-83-3) + 3,5-dichloroisonicotinoyl chloride (229328-97-6) → ethyl N-(3,5-dichloroisonicotinoyl)-4-[(3-nitropyridin-2-yl)amino]-L-phenylalaninate (1031341-56-6)

Guidance literature:

With triethylamine; In dichloromethane; for 60h;

Reference yield: 92.0%

3-[2-(4-amino-phenyl)-1-methoxycarbonyl-ethylcarbamoyl]-2-aza-bicyclo[2.2.2]octane-2-carboxylic acid benzyl ester (851535-43-8) + 3,5-dichloroisonicotinoyl chloride (229328-97-6) → 3-(2-{4-[(3,5-dichloro-pyridine-4-carbonyl)-amino]-phenyl}-1-methoxycarbonyl-ethylcarbamoyl)-2-aza-bicyclo[2.2.2]octane-2-carboxylic acid benzyl ester

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃;

upstream raw materials:

3-(4-aminophenyl)-2-{3-[(2,2-dimethylpropionyl)isobutylamino]-4-methoxyphenyl} propionic acid ethyl ester

Downstream raw materials:

N-Boc-4-[(3',5'-dichloroisonicotinoyl)amino]-(L)-phenylalanine ethyl ester

3-[4-(3,5-dichloropyridine-4-carbonylamino) phenyl]-2-{3-[(2,2-dimethylpropionyl)isobutylamino]-4-methoxyphenyl}propionic acid ethyl ester