Benzenecarboximidoyl chloride, N-(4-methoxyphenyl)-

Base Information

• Chemical Name: Benzenecarboximidoyl chloride, N-(4-methoxyphenyl)-
• CAS No.: 34918-74-6
• Molecular Formula: C14H12ClNO
• Molecular Weight: 245.708
• DSSTox Substance ID: DTXSID00479075
• Nikkaji Number: J450.158F
• Mol file: 34918-74-6.mol

Synonyms:Benzenecarboximidoyl chloride, N-(4-methoxyphenyl)-;34918-74-6;SCHEMBL11384776;DTXSID00479075;NEWKPFLKMVAEKU-UHFFFAOYSA-N;N-(4-methoxyphenyl)benzimidoyl chloride;N-(4-methoxyphenyl)-benzimidoyl chloride

Chemical Property of Benzenecarboximidoyl chloride, N-(4-methoxyphenyl)-

Chemical Property:

• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 245.0607417
• Heavy Atom Count: 17
• Complexity: 253

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)N=C(C2=CC=CC=C2)Cl

Technology Process of Benzenecarboximidoyl chloride, N-(4-methoxyphenyl)-

There total 4 articles about Benzenecarboximidoyl chloride, N-(4-methoxyphenyl)- 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: 99.0%

N-(p-methoxyphenyl)benzamide (7472-54-0) → N-(4-methoxyphenyl)benzimidoyl chloride (34918-74-6)

Guidance literature:

With dmap; phosphorus trichloride; at 75 - 80 ℃; for 1h;

DOI:10.1134/S1070428021050134

Reference yield:

4-methoxy-aniline (104-94-9) → N-(4-methoxyphenyl)benzimidoyl chloride (34918-74-6)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / ethyl acetate / 20 °C

2: thionyl chloride / 4 h / 135 °C

With thionyl chloride; triethylamine; In ethyl acetate;

DOI:10.1021/jm201463v

Reference yield:

benzoyl chloride (98-88-4) → N-(4-methoxyphenyl)benzimidoyl chloride (34918-74-6)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / ethyl acetate / 20 °C

2: thionyl chloride / 4 h / 135 °C

With thionyl chloride; triethylamine; In ethyl acetate;

DOI:10.1021/jm201463v

upstream raw materials:

N-(p-methoxyphenyl)benzamide

benzoyl chloride

4-methoxy-aniline

Downstream raw materials:

5-ethyl-3-(4-methoxy-phenyl)-6-methyl-2-phenyl-3H-pyrimidin-4-one

4-hydroxy-6-methoxy-2-phenyl-quinoline-3-carboxylic acid ethyl ester

phenyl N-(4-methoxyphenyl)benzimidate

1-(4-hydroxy-6-methoxy-2-phenyl-[3]quinolyl)-ethanone