Ethanimidic acid, N-phenyl-, methyl ester

Base Information

• Chemical Name: Ethanimidic acid, N-phenyl-, methyl ester
• CAS No.: 24433-81-6
• Molecular Formula: C9H11NO
• Molecular Weight: 149.192
• DSSTox Substance ID: DTXSID60473978
• Nikkaji Number: J548.439A,J635.853E
• Mol file: 24433-81-6.mol

Synonyms:Ethanimidic acid, N-phenyl-, methyl ester;24433-81-6;1-methoxy-N-phenylethanimine;SCHEMBL16642285;SCHEMBL21843092;DTXSID60473978;methyl (1Z)-N-phenylethanimidoate

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

Chemical Property:

• Boiling Point: 206.4±23.0 °C(Predicted)
• PSA: 21.59000
• Density: 0.94±0.1 g/cm3(Predicted)
• LogP: 2.38290
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 149.084063974
• Heavy Atom Count: 11
• Complexity: 137

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=NC1=CC=CC=C1)OC

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

There total 12 articles about Ethanimidic 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: 95.0%

(CO)5WN(C6H5)N(C6H5)C(CH3)(OCH3) (118070-62-5) → (CO)5W((C6H5)3PN(C6H5)) (122444-51-3) + (1-methoxyethylidene)-N-phenylamine (24433-81-6)

Guidance literature:

With triphenylphosphine; In not given; Irradiation (UV/VIS); thermal or photochemical; Kinetics;

DOI:10.1021/ja00202a048

Reference yield: 73.0%

thioacetic acid O-methyl ester (21119-13-1) + Phenyl azide (622-37-7) → (1-methoxyethylidene)-N-phenylamine (24433-81-6)

Guidance literature:

at 80 ℃; for 16h;

DOI:10.1002/hlca.19950780609

Reference yield: 70.0%

pentacarbonyl(methoxymethylcarbene)chromium(0) (20540-69-6) + S,S-dimethyl-N-phenylsulfilimine (20094-91-1) → (1-methoxyethylidene)-N-phenylamine (24433-81-6)

Guidance literature:

DOI:10.1021/om00047a007

upstream raw materials:

Acetanilid

methyl iodide

dimethyl sulfate

thioacetic acid O-methyl ester

Downstream raw materials:

N,N-Diphenyl-acetamidine

N-acetyl-N-methylaniline