2-(Methoxymethyl)aniline

Base Information

• Chemical Name: 2-(Methoxymethyl)aniline
• CAS No.: 62723-78-8
• Molecular Formula: C8H11NO
• Molecular Weight: 137.181
• European Community (EC) Number: 815-868-3
• DSSTox Substance ID: DTXSID30491023
• Nikkaji Number: J1.802.504C
• Wikidata: Q82335172
• Mol file: 62723-78-8.mol

Synonyms:2-(methoxymethyl)aniline;62723-78-8;MFCD09811778;2-methoxymethylaniline;Benzenamine, methoxymethyl-;o-methoxymethylaniline;SCHEMBL1720477;DTXSID30491023;ZHERWZMAGGWSIX-UHFFFAOYSA-N;AKOS000159241;BS-13226;SY175179;EN300-41039

Chemical Property of 2-(Methoxymethyl)aniline

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 137.084063974
• Heavy Atom Count: 10
• Complexity: 95.3

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COCC1=CC=CC=C1N

Technology Process of 2-(Methoxymethyl)aniline

There total 17 articles about 2-(Methoxymethyl)aniline 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: 98.4%

1-(methoxymethyl)-2-nitrobenzene (38177-30-9) → 2-methoxymethylaniline (62723-78-8)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In methanol; water; at 55 - 70 ℃; under 9000.9 Torr; Pressure; Temperature; Reagent/catalyst; Sealed tube;

Reference yield: 71.0%

2-Aminobenzyl alcohol (5344-90-1) + methanol (67-56-1) → 2-methoxymethylaniline (62723-78-8)

Guidance literature:

With sulfuric acid; at 0 - 50 ℃; for 7h; Reflux;

DOI:10.1021/ja5034638

Reference yield: 30.0%

N-(2-(methoxymethyl)phenyl)-1,1-diphenylmethanimine → 2-methoxymethylaniline (62723-78-8)

Guidance literature:

With hydrogenchloride; In tetrahydrofuran; at 20 ℃; Inert atmosphere; Schlenk technique;

DOI:10.1002/chem.202101124

upstream raw materials:

1-(methoxymethyl)-2-nitrobenzene

2-methoxymethyl-benzoic acid amide

methanol

2-nitrobenzyl chloride

Downstream raw materials:

2-methoxymethylphenyl isocyanate

C₂₀H₁₇NO₂

2-(but-3-en-1-yl)aniline

2-bromo-N-(2-(but-3-enyl)phenyl)acetamide

Refernces

• 1、 -. "PESTICIDAL COMPOSITIONS AND METHODS". Page/Page column 93. . Retrieved 2020/07/15.
• 2、 Wang, Xiaoyang,Li, Miao,Yang, Yanyan,Guo, Minjie,Tang, Xiangyang,Wang, Guangwei. "One-pot Construction of Difluorinated Pyrrolizidine and Indolizidine Scaffolds via Copper-Catalyzed Radical Cascade Annulation". supporting information. p. 2151 - 2156. Retrieved 2018/04/26.