2-[2-(2-Amino-2-oxoethyl)phenyl]acetamide

Base Information

• Chemical Name: 2-[2-(2-Amino-2-oxoethyl)phenyl]acetamide
• CAS No.: 7500-54-1
• Molecular Formula: C10H12N2O2
• Molecular Weight: 192.217
• NSC Number: 401682
• DSSTox Substance ID: DTXSID70322620
• Nikkaji Number: J856.145A
• Wikidata: Q82081297
• Mol file: 7500-54-1.mol

Synonyms:2-[2-(2-amino-2-oxoethyl)phenyl]acetamide;7500-54-1;2,2'-(1,2-Phenylene)diacetamide;o-Benzenediacetamide;NSC401682;o-phenylenediacetamide;1,2-Benzenedi(acetamide);SCHEMBL10339218;DTXSID70322620;NSC 401682;NSC-401682

Chemical Property of 2-[2-(2-Amino-2-oxoethyl)phenyl]acetamide

Chemical Property:

• XLogP3: -0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 192.089877630
• Heavy Atom Count: 14
• Complexity: 204

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)CC(=O)N)CC(=O)N

Technology Process of 2-[2-(2-Amino-2-oxoethyl)phenyl]acetamide

There total 4 articles about 2-[2-(2-Amino-2-oxoethyl)phenyl]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: 79.0%

1,2-phenylenediacetonitrile (613-73-0) → o-xylylenediamide (7500-54-1)

Guidance literature:

1,2-phenylenediacetonitrile; With acetamide; acetic acid; at 50 ℃; for 0.5h; under 760.051 Torr;

With tetrakis(acetonitrile)palladium(II) tetrafluoroborate; at 50 ℃; for 2h; under 1 - 3 Torr;

DOI:10.1055/s-0039-1690026

Reference yield: 65.0%

1,2-phenylenediacetonitrile (613-73-0) → o-Cyanmethyl-phenylessigsaeure (56066-94-5) + o-xylylenediamide (7500-54-1)

Guidance literature:

With water; for 24h; Rhodococcus rhodochrous AJ₂₇₀;

DOI:10.1039/a700859g

Reference yield: 11.0%

1,2-phenylenediacetonitrile (613-73-0) → o-xylylenediamide (7500-54-1) + 2-(2-Cyanomethyl-phenyl)-acetamide

Guidance literature:

With potassium phosphate buffer; Rhodococcus sp. AJ₂₇₀; at 30 ℃; for 24h;

DOI:10.1039/a703904b

upstream raw materials:

1,2-phenylenediacetonitrile

Downstream raw materials:

3-(toluene-4-sulfonyl)-2,3,4,5-tetrahydro-1H-benz[d]azepine

1,3,4,5-tetrahydro-2H-benzo[d]azepin-2-one

1,2-Phenylenediacetic acid

(2-carbamoylmethyl-phenyl)-acetic acid

Refernces

• 1、 Meth-Cohn, Otto,Wang, Mei-Xiang. "Rationalisation of the regioselective hydrolysis of aliphatic dinitriles with Rhodococcus rhodochrous AJ270". . p. 1041 - 1042. Retrieved 2007/10/03.