Essigsure, [2-(aminocarbonyl)phenoxy]-, ethylester

Base Information

• Chemical Name: Essigsure, [2-(aminocarbonyl)phenoxy]-, ethylester
• CAS No.: 90074-90-1
• Molecular Formula: C11H13 N O4
• Molecular Weight: 223.229
• Mol file: 90074-90-1.mol

Synonyms:Aceticacid, (o-carbamoylphenoxy)-, ethyl ester (6CI); Acetic acid,[2-(aminocarbonyl)phenoxy]-, ethyl ester (9CI);[2-(Aminocarbonyl)phenoxy]acetic acid ethyl ester

Chemical Property of Essigsure, [2-(aminocarbonyl)phenoxy]-, ethylester

Chemical Property:

• Melting Point: 128-129 °C
• Boiling Point: 369.5±22.0 °C(Predicted)
• PKA: 15.54±0.50(Predicted)
• PSA: 78.62000
• Density: 1.205±0.06 g/cm3(Predicted)
• LogP: 1.42770

Purity/Quality:

Ethyl[2-(aminocarbonyl)phenoxy]acetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Essigsure, [2-(aminocarbonyl)phenoxy]-, ethylester

There total 9 articles about Essigsure, [2-(aminocarbonyl)phenoxy]-, ethylester 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: 92.0%

ethyl bromoacetate (105-36-2) + salicylamide (65-45-2) → 2-(ethoxycarbonylmethyloxy)benzamide (90074-90-1)

Guidance literature:

With potassium carbonate; In acetone; for 4h; Heating;

DOI:10.1016/j.bmc.2005.10.046

Reference yield:

2-Formylphenoxyacetic acid (6280-80-4) → 2-(ethoxycarbonylmethyloxy)benzamide (90074-90-1)

Guidance literature:

Multi-step reaction with 4 steps

1: 66 percent / conc. H₂SO₄ / 20 h / Heating

2: 50 percent / potassium bromate / acetic acid; acetone; H₂O / 0.5 h / Heating

3: oxalyl chloride

4: NH₃

With potassium bromate; oxalyl dichloride; sulfuric acid; ammonia; In water; acetic acid; acetone;

Reference yield:

ethyl (2-formylphenoxy)acetate (41873-61-4) → 2-(ethoxycarbonylmethyloxy)benzamide (90074-90-1)

Guidance literature:

Multi-step reaction with 3 steps

1: 50 percent / potassium bromate / acetic acid; acetone; H₂O / 0.5 h / Heating

2: oxalyl chloride

3: NH₃

With potassium bromate; oxalyl dichloride; ammonia; In water; acetic acid; acetone;

upstream raw materials:

ethanol

2-(2-carbamoylphenoxy)acetic acid

chloroacetic acid ethyl ester

salicylamide

Downstream raw materials:

2-{[2-(2-Hydroxy-2-phenyl-ethylamino)-ethylcarbamoyl]-methoxy}-benzamide

2,3,4,5-tetrahydro-1,4-benzoxazepine-3,5-dione

4-[4-[4-(2-pyrimidinyl)piperazin-1-yl]butyl]-1,4-benzoxazepine-3,5(2H,4H)-dione

Piclozotan

Refernces

• 1、 Kamei,Maeda,Ogino,Koyama,Nakajima,Tatsuoka,Ohno,Inoue. "New 5-HT1A receptor agonists possessing 1,4-benzoxazepine scaffold exhibit highly potent anti-ischemic effects.". . p. 595 - 598. Retrieved 2007/10/03.