2-chloro-N-(3-methoxyphenyl)acetamide

Base Information

• Chemical Name: 2-chloro-N-(3-methoxyphenyl)acetamide
• CAS No.: 17641-08-6
• Molecular Formula: C9H10ClNO2
• Molecular Weight: 199.637
• Hs Code.: 2924299090
• European Community (EC) Number: 633-073-8
• DSSTox Substance ID: DTXSID30170129
• Nikkaji Number: J54.168K
• Wikidata: Q83039992
• Mol file: 17641-08-6.mol

Synonyms:2-chloro-N-(3-methoxyphenyl)acetamide;17641-08-6;2-Chloro-N-(3-methoxy-phenyl)-acetamide;2-Chloro-m-acetanisidide;Acetamide, 2-chloro-N-(3-methoxyphenyl)-;N-(3-Anisyl)chloroacetamide;N-(Chloroacetyl)-m-anisidide;BRN 1104501;Acetamide, 2-chloro-N-(3-methoxyphenyl)- (9CI);m-ACETANISIDIDE, 2-CHLORO-;Acetamide,2-chloro-N-(3-methoxyphenyl)-;F1791-1517;SCHEMBL1837650;DTXSID30170129;MFCD00018900;STK414995;AKOS000265799;2-chloro-N-(3-methoxyphenyl)-acetamide;AS-64579;BB 0243215;CS-0074143;EN300-01584;W18701;Z56896296

Chemical Property of 2-chloro-N-(3-methoxyphenyl)acetamide

Chemical Property:

• Vapor Pressure: 9.98E-06mmHg at 25°C
• Refractive Index: 1.573
• Boiling Point: 371.9 °C at 760 mmHg
• Flash Point: 178.7 °C
• PSA: 38.33000
• Density: 1.264 g/cm³
• LogP: 1.94550
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 199.0400063
• Heavy Atom Count: 13
• Complexity: 175

Purity/Quality:

99% ^*data from raw suppliers

2-Chloro-n-(3-methoxyphenyl)acetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)NC(=O)CCl
• Uses: 2-Chloro-n-(3-methoxyphenyl)acetamide. Aripiprazole Impurity

Technology Process of 2-chloro-N-(3-methoxyphenyl)acetamide

There total 3 articles about 2-chloro-N-(3-methoxyphenyl)acetamide 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: 94.0%

Chloroiodomethane (593-71-5) + 3-methoxyphenyl isocyanate (18908-07-1) → 2-chloro-N-(3-methoxyphenyl)acetamide (17641-08-6)

Guidance literature:

With methyllithium lithium bromide; In diethyl ether; at -78 ℃;

DOI:10.1039/c3cc44255a

Reference yield: 92.0%

m-Anisidine (536-90-3,918666-97-4) + chloroacetyl chloride (79-04-9) → 2-chloro-N-(3-methoxyphenyl)acetamide (17641-08-6)

Guidance literature:

In tetrahydrofuran; at 0 - 10 ℃; for 3h;

DOI:10.1039/b503615a

Reference yield: 63.8%

→ 2-chloro-N-(3-methoxyphenyl)acetamide (17641-08-6)

Guidance literature:

With pyridine; In water; at 0 ℃; for 1h; Cooling with ice;

upstream raw materials:

m-Anisidine

chloroacetyl chloride

Chloroiodomethane

3-methoxyphenyl isocyanate

Downstream raw materials:

N-(3-methoxy-phenyl)-2-piperidin-1-yl-acetamide

N,N-diethyl-glycine m-anisidide

N-glycoloyl-m-anisidine

N-ethoxyacetyl-m-anisidine