2-chloro-N-(4-chlorophenyl)acetamide

Base Information

• Chemical Name: 2-chloro-N-(4-chlorophenyl)acetamide
• CAS No.: 3289-75-6
• Molecular Formula: C8H7 Cl2 N O
• Molecular Weight: 204.056
• Hs Code.: 2924299090
• European Community (EC) Number: 636-504-8
• NSC Number: 8369
• DSSTox Substance ID: DTXSID90186544
• Nikkaji Number: J1.395.872F
• Wikidata: Q72456637
• ChEMBL ID: CHEMBL531947
• Mol file: 3289-75-6.mol

Synonyms:2-chloro-N-(4-chlorophenyl)acetamide;3289-75-6;N-(4-Chlorophenyl)-2-chloroacetamide;N1-(4-Chlorophenyl)-2-Chloroacetamide;Acetamide, 2-chloro-N-(4-chlorophenyl)-;MFCD00018904;GNF-Pf-1811;NSC8369;NSC 8369;AI3-23540;Acetanilide, 2,4'-dichloro-;CHEMBL531947;SCHEMBL1503954;Acetanilide, 2,4'-dichloro-,;DTXSID90186544;UDRCRMHFHHTVSN-UHFFFAOYSA-N;ART-CHEM-BB B015617;BCP08999;NSC-8369;chloro(N-(p-chlorophenyl))acetamide;STK117386;AKOS000268724;SB77821;SY081416;BB 0217605;CS-0072708;FT-0602134;EN300-01752;8G-976;F30176;2-CHLORO-N~1~-(4-CHLOROPHENYL)ACETAMIDE;A875488;J-509079;Z56867253;F1791-1505

Chemical Property of 2-chloro-N-(4-chlorophenyl)acetamide

Chemical Property:

• Vapor Pressure: 1.24E-05mmHg at 25°C
• Melting Point: 168 °C
• Boiling Point: 368.8 °C at 760 mmHg
• PKA: 12.02±0.70(Predicted)
• Flash Point: 176.8 °C
• PSA: 29.10000
• Density: 1.399 g/cm³
• LogP: 2.59030
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 202.9904692
• Heavy Atom Count: 12
• Complexity: 155

Purity/Quality:

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

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

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39-22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC(=O)CCl)Cl

Technology Process of 2-chloro-N-(4-chlorophenyl)acetamide

There total 6 articles about 2-chloro-N-(4-chlorophenyl)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: 98.0%

4-chloro-aniline (106-47-8) + chloroacetyl chloride (79-04-9) → 2-chloro-N-(4-chlorophenyl)acetamide (3289-75-6)

Guidance literature:

With sodium hydrogencarbonate; In 1,4-dioxane; for 0.5h;

DOI:10.1007/BF00758665

Reference yield: 82.0%

→ 2-chloro-N-(4-chlorophenyl)acetamide (3289-75-6)

Guidance literature:

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

In dichloromethane; for 2h; Cooling with ice;

Reference yield:

4-chloro-aniline (106-47-8) + Chloroacetic anhydride (541-88-8) → 2-chloro-N-(4-chlorophenyl)acetamide (3289-75-6)

Guidance literature:

In tetrahydrofuran;

DOI:10.1016/j.bmc.2017.02.009

upstream raw materials:

4-chloro-aniline

chloroacetyl chloride

chloroacetyl isothiocyanate

sulfuric acid

Downstream raw materials:

2-(piperidinyl)-N-(4-chlorophenyl) acetamide

1-[(4-chloro-phenylcarbamoyl)-methyl]-pyridinium; chloride

(4,5-dihydroimidazolyl-2-mercapto)-p-2-chloroacetanilide hydrochloride

3-Amino-thieno[2,3-b]quinoline-2-carboxylic acid (4-chloro-phenyl)-amide

Refernces

• 1、 Lee, Seungheon,Ku, Angela F.,Vippila, Mohana Rao,Wang, Yong,Zhang, Minjia,Wang, Xingyou,Hedstrom, Lizbeth,Cuny, Gregory D.. "Mycophenolic anilides as broad specificity inosine-5’-monophosphate dehydrogenase (IMPDH) inhibitors". . . Retrieved 2020.
• 2、 Bozdeveci, Arif,Krishna, Vagolu Siva,Sriram, Dharmarajan,Alpay Karao?lu, ?engül,Kü?ükgüzel, ?lkay,Kulaba?, Necla,Türe, Asl?. "Novel fluoroquinolones containing 2-arylamino-2-oxoethyl fragment: Design, synthesis, evaluation of antibacterial and antituberculosis activities and molecular modeling studies". . . Retrieved 2022/01/11.
• 3、 Mishra, Raghav,Kumar, Nitin,Sachan, Neetu. "Synthesis, pharmacological evaluation, and in-silico studies of thiophene derivatives". . . Retrieved 2021/12/23.