2-Chloro-N-(4-methoxyphenyl)acetamide

Base Information

• Chemical Name: 2-Chloro-N-(4-methoxyphenyl)acetamide
• CAS No.: 22303-36-2
• Molecular Formula: C9H10ClNO2
• Molecular Weight: 199.637
• Hs Code.: 2924299090
• European Community (EC) Number: 688-774-1
• NSC Number: 8373
• DSSTox Substance ID: DTXSID70176847
• Nikkaji Number: J54.169I
• Wikidata: Q83047170
• ChEMBL ID: CHEMBL2164309
• Mol file: 22303-36-2.mol

Synonyms:2-Chloro-N-(4-methoxyphenyl)acetamide;22303-36-2;2-Chloro-p-acetanisidide;N-(Chloroacetyl)-p-anisidide;p-ACETANISIDIDE, 2-CHLORO-;2-Chloro-N-(4-Methoxy-Phenyl)-Acetamide;N-(p-Anisyl)chloroacetamide;N-(4-Anisyl)chloroacetamide;Acetamide, 2-chloro-N-(4-methoxyphenyl)-;N-(p-Methoxyphenyl)chloroacetamide;NSC 8373;2-chloro-n-(4-methoxyphenyl)ethanamide;BRN 0779019;AI3-23554;MFCD00018907;Acetamide, 2-chloro-N-(4-methoxyphenyl)- (9CI);NSC8373;Acetamide,2-chloro-N-(4-methoxyphenyl)-;WLN: G1VMR DO1;2-Chloro-para-acetanisidide;SCHEMBL1289638;CHEMBL2164309;DTXSID70176847;n-(chloroacetyl)-4-methoxyaniline;p-Methoxy-alpha-chloroacetoanilide;N-(4-methoxyphenyl)chloroacetamide;NSC-8373;STK115692;AKOS000266639;2-chloro-N-(4-methoxyphenyl)-acetamide;2-Chloro-N-(4-methoxyphenyl)acetamide #;Acetamide, N-(4-methoxyphenyl)-2-chloro-;BB 0217607;FT-0629680;EN300-01523;3W-0415;J-509084;Z56862381;F1791-1518

Chemical Property of 2-Chloro-N-(4-methoxyphenyl)acetamide

Chemical Property:

• Vapor Pressure: 6.26E-06mmHg at 25°C
• Melting Point: 121-122°C
• Refractive Index: 1.573
• Boiling Point: 378.5 °C at 760 mmHg
• PKA: 12.31±0.70(Predicted)
• Flash Point: 182.7 °C
• PSA: 38.33000
• Density: 1.264 g/cm³
• LogP: 1.94550
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 199.0400063
• Heavy Atom Count: 13
• Complexity: 167

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Chloro-N-(4-methoxyphenyl)acetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)NC(=O)CCl

Technology Process of 2-Chloro-N-(4-methoxyphenyl)acetamide

There total 12 articles about 2-Chloro-N-(4-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: 100.0%

4-methoxy-aniline (104-94-9) + chloroacetyl chloride (79-04-9) → N-(4-methoxyphenyl)-2-chloroacetamide (22303-36-2)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; at 0 ℃; for 0.166667h;

Reference yield: 90.0%

→ N-(4-methoxyphenyl)-2-chloroacetamide (22303-36-2)

Guidance literature:

With sodium hydrogencarbonate; In dichloromethane; at 20 ℃; for 0.166667h;

In dichloromethane; for 2h; Cooling with ice;

Reference yield: 80.0%

4-methoxy-aniline (104-94-9) → N-(4-methoxyphenyl)-2-chloroacetamide (22303-36-2)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; chloroacetyl chloride; In dichloromethane; at 0 ℃; for 2.33h;

DOI:10.1039/d1md00187f

upstream raw materials:

4-methoxy-aniline

chloroacetic acid

chloroacetyl chloride

(4-methoxyphenyl-benzylidene)-carbamic acid methyl ester

Downstream raw materials:

N-(4-methoxy-phenyl)-2-piperidin-1-yl-acetamide

N-(4-methoxy-phenyl)-glycine p-anisidide

N-(4-methoxy-phenyl)-2-morpholin-4-yl-acetamide

N-(4-Methoxy-phenyl)-2-(quinolin-8-yloxy)-acetamide

Refernces

• 1、 Abdalla, Ashraf N.,Almalki, Faisal A.,El Hassab, Mahmoud A.,Gouda, Ahmed M.,Shawky, Ahmed M.. "In silico approach using free software to optimize the antiproliferative activity and predict the potential mechanism of action of pyrrolizine-based schiff bases". . . Retrieved 2021.
• 2、 Gangar, Mukesh,Goyal, Sandeep,Raykar, Digambar,Khurana, Princy,Martis, Ashwita M.,Goswami, Avijit,Ghoshal, Ishani,Patel, Ketul V.,Nagare, Yadav,Raikar, Santosh,Mukherjee, Apurba,Cyriac, Rajath,Paquin, Jean-Fran?ois,Kulkarni, Aditya. "Design, synthesis and biological evaluation studies of novel small molecule ENPP1 inhibitors for cancer immunotherapy". supporting information. . Retrieved 2021/12/20.
• 3、 Salem, Manar G.,Abdel Aziz, Yasmine M.,Elewa, Marwa,Nafie, Mohamed S.,Elshihawy, Hosam A.,Said, Mohamed M.. "Synthesis, molecular modeling, selective aldose reductase inhibition and hypoglycemic activity of novel meglitinides". . . Retrieved 2021/04/29.