N-[2-(3-Methoxyphenyl)ethyl]formamide

Base Information

• Chemical Name: N-[2-(3-Methoxyphenyl)ethyl]formamide
• CAS No.: 110339-54-3
• Molecular Formula: C10H13NO2
• Molecular Weight: 179.219
• DSSTox Substance ID: DTXSID00543902
• Nikkaji Number: J531.196I
• Wikidata: Q82420865
• Mol file: 110339-54-3.mol

Synonyms:110339-54-3;N-[2-(3-Methoxyphenyl)ethyl]formamide;Formamide, N-[2-(3-methoxyphenyl)ethyl]-;N-formyl-3-methoxy-phenethylamine;SCHEMBL2473241;N-formyl-3-methoxyphenethylamine;DTXSID00543902;ZTFODYARLDKLAZ-UHFFFAOYSA-N;N-[2-(3-methoxy-phenyl)-ethyl]-formamide

Chemical Property of N-[2-(3-Methoxyphenyl)ethyl]formamide

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 179.094628657
• Heavy Atom Count: 13
• Complexity: 150

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)CCNC=O

Technology Process of N-[2-(3-Methoxyphenyl)ethyl]formamide

There total 8 articles about N-[2-(3-Methoxyphenyl)ethyl]formamide 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%

2-(3-methoxyphenyl)-1-ethanamine (2039-67-0) + formic acid ethyl ester (109-94-4) → N-[2-(3-methoxy-phenyl)-ethyl]-formamide (110339-54-3)

Guidance literature:

In toluene; for 6h; Heating;

DOI:10.1021/jo00059a056

Reference yield: 93.0%

propionic acid (802294-64-0,79-09-4) + 2-(3-methoxyphenyl)-1-ethanamine (2039-67-0) → N-[2-(3-methoxy-phenyl)-ethyl]-formamide (110339-54-3)

Guidance literature:

at 0 ℃; for 12.5h; Reflux;

DOI:10.1111/cbdd.12153

Reference yield: 74.0%

3-(3-Methoxy-phenyl)-propionic acid (10516-71-9) → N-[2-(3-methoxy-phenyl)-ethyl]-formamide (110339-54-3)

Guidance literature:

3-(3-Methoxy-phenyl)-propionic acid; With diphenyl phosphoryl azide; triethylamine; In toluene; at 80 ℃; Inert atmosphere;

With sodium tetrahydroborate; In water; tert-butyl alcohol; at 20 ℃; for 0.0375h; Inert atmosphere;

DOI:10.1002/anie.201508500

upstream raw materials:

formic acid

2-(3-methoxyphenyl)-1-ethanamine

formic acid ethyl ester

propionic acid

Downstream raw materials:

6-Methoxy-3,4-dihydroisoquinoline

2-(3-methoxyphenyl)-1-ethanamine

PD 102807

6-methoxy-1,2,3,4-tetrahydro-isoquinoline