4-Chloro-N-phenylpicolinamide

Base Information

• Chemical Name: 4-Chloro-N-phenylpicolinamide
• CAS No.: 133928-61-7
• Molecular Formula: C12H9ClN2O
• Molecular Weight: 232.669
• Hs Code.: 2933399990
• NSC Number: 112830
• DSSTox Substance ID: DTXSID90296950
• Nikkaji Number: J931.826G
• Wikidata: Q82037800
• Mol file: 133928-61-7.mol

Synonyms:4-Chloro-N-phenylpicolinamide;133928-61-7;4-chloro-N-phenylpyridine-2-carboxamide;MFCD08523032;NSC112830;SCHEMBL6072225;DTXSID90296950;AR3401;AKOS001303760;NSC-112830;Trithiocyanuric acidtrisodium salthydrate;4-Chloro-N-phenyl-pyridine-2-carboxamide;AS-45598;4-Chloro-N-phenylpicolinamide, AldrichCPR;CS-0171404;FT-0681659;A887993;Z82191561

Chemical Property of 4-Chloro-N-phenylpicolinamide

Chemical Property:

• PSA: 41.99000
• LogP: 3.06030
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 232.0403406
• Heavy Atom Count: 16
• Complexity: 241

Purity/Quality:

97% ^*data from raw suppliers

4-Chloro-n-phenylpicolinamide ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC(=O)C2=NC=CC(=C2)Cl

Technology Process of 4-Chloro-N-phenylpicolinamide

There total 12 articles about 4-Chloro-N-phenylpicolinamide 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%

4-chloro-3-trimethylsilylpicolinanilide (133928-65-1) → N-phenyl-4-chloro-2-pyridinecarboxamide (133928-61-7)

Guidance literature:

With potassium fluoride; In methanol; Product distribution; Heating; other anilides;

DOI:10.1016/S0040-4020(01)96912-1

Reference yield: 84.0%

4-chloropicolinic acid (5470-22-4) + aniline (62-53-3) → N-phenyl-4-chloro-2-pyridinecarboxamide (133928-61-7)

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃;

DOI:10.1021/ol500464x

Reference yield: 78.0%

4-chloro-pyridine-2-carbonyl chloride (53750-66-6) + aniline (62-53-3) → N-phenyl-4-chloro-2-pyridinecarboxamide (133928-61-7)

Guidance literature:

In dichloromethane; at 0 - 20 ℃; for 3.5h;

DOI:10.1039/c8md00057c

upstream raw materials:

4-chloro-pyridine-2-carbonyl chloride

aniline

4-chloro-3-trimethylsilylpicolinanilide

4-Chloro-pyridine-2-carboxylic acid methyl ester

Downstream raw materials:

4-chloro-3-trimethylsilylpicolinanilide

C₁₂H₈⁽²⁾HClN₂O

4-Chloro-3-methyl-pyridine-2-carboxylic acid phenylamide

4-chloro-3,N-dimethylpicolinanilide