Benzenecarboximidic acid, N-phenyl-, methyl ester

Base Information

• Chemical Name: Benzenecarboximidic acid, N-phenyl-, methyl ester
• CAS No.: 6780-39-8
• Molecular Formula: C14H13NO
• Molecular Weight: 211.263
• DSSTox Substance ID: DTXSID50441424
• Nikkaji Number: J687.453C
• Mol file: 6780-39-8.mol

Synonyms:Benzenecarboximidic acid, N-phenyl-, methyl ester;methyl N-phenylbenzenecarboximidate;6780-39-8;methyl N-phenyl-benzimidate;SCHEMBL5178578;SCHEMBL18100417;DTXSID50441424;methyl N-phenylbenzenecarboximidoate;N-Phenyl-alpha-methoxybenzylideneamine;AJ-797/11461340

Chemical Property of Benzenecarboximidic acid, N-phenyl-, methyl ester

Chemical Property:

• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 211.099714038
• Heavy Atom Count: 16
• Complexity: 225

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=NC1=CC=CC=C1)C2=CC=CC=C2

Technology Process of Benzenecarboximidic acid, N-phenyl-, methyl ester

There total 23 articles about Benzenecarboximidic acid, N-phenyl-, methyl ester 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%

Nitrosobenzene (586-96-9) + orthobenzoic acid trimethyl ester (707-07-3) → E-[2-methoxy-1-phenyl-methylene]-phenylamine (6780-39-8)

Guidance literature:

With indium; acetic acid; In benzene; for 0.166667h; Reflux;

DOI:10.1016/j.tet.2009.08.059

Reference yield: 70.0%

(CO)5W(N(C6H5)N(C6H5)C(C6H5)OCH3) → (CO)5W{C6H5NC(OCH3)(C6H5)} (141556-62-9) + E-[2-methoxy-1-phenyl-methylene]-phenylamine (6780-39-8)

Guidance literature:

In chloroform-d1; Irradiation (UV/VIS); inert gas; -50 ° C;;

DOI:10.1021/ja00039a029

Reference yield: 65.0%

methyl thiobenzoate (5873-86-9) + Phenyl azide (622-37-7) → E-[2-methoxy-1-phenyl-methylene]-phenylamine (6780-39-8)

Guidance literature:

at 80 ℃; for 24h;

DOI:10.1002/hlca.19950780609

upstream raw materials:

2-phenyl-2-(phenylimino)acetonitrile

sodium methylate

N-phenyl-benzimidoyl chloride

methanol

Downstream raw materials:

N-(diphenylmethylidene)phenylamine

N-methyl-N-phenyl-benzamide

N-phenyl benzoyl amide

methylene chloride

Refernces

• 1、 Roychowdhury, Abhijit,Kumar, Versha V.,Bhaduri. "Diarylimidoylcyanides, an attractive class of intermediate: Novel synthesis of α-anilino-β-nitroenamines, N, N′- Disubstituted amidines and substituted phenyl glyoxate". . p. 715 - 727. Retrieved 2007/10/03.
• 2、 Maxey, Claudia Tata,Sleiman, Hanadi F.,Massey, Scott T.,White, Lisa McElwee. "Metathesis and diaziridination reactions of (CO)5W = C(OMe)-p-XC6H4 with cis-azobenzene. Electronic and solvent effects". . p. 5153 - 5160. Retrieved 2007/10/02.