BENZENEETHANIMIDAMIDE, N-HYDROXY-3-NITRO

Base Information

• Chemical Name: BENZENEETHANIMIDAMIDE, N-HYDROXY-3-NITRO
• CAS No.: 1028344-62-8
• Molecular Formula: C8H9N3O3
• Molecular Weight: 195.17536
• Mol file: 1028344-62-8.mol

Synonyms:BENZENEETHANIMIDAMIDE, N-HYDROXY-3-NITRO

Chemical Property of BENZENEETHANIMIDAMIDE, N-HYDROXY-3-NITRO

Chemical Property:

• PSA: 104.43000
• LogP: 2.10720

Purity/Quality:

98%Min ^*data from raw suppliers

BENZENEETHANIMIDAMIDE,N-HYDROXY-3-NITRO 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of BENZENEETHANIMIDAMIDE, N-HYDROXY-3-NITRO

There total 2 articles about BENZENEETHANIMIDAMIDE, N-HYDROXY-3-NITRO 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: 85.0%

(3-nitrophenyl)acetonitrile (621-50-1) → (Z)-N'-hydroxy-2-(3-nitrophenyl)acetimidamide (1028344-62-8)

Guidance literature:

With methanol; hydroxylamine hydrochloride; sodium methylate; In dimethyl sulfoxide; at 100 ℃; for 4h;

Reference yield:

1-bromomethyl-3-nitrobenzene (3958-57-4) → (Z)-N'-hydroxy-2-(3-nitrophenyl)acetimidamide (1028344-62-8)

Guidance literature:

Multi-step reaction with 2 steps

1: N,N-dimethyl-formamide / 5 h / 50 °C

2: hydroxylamine hydrochloride; sodium methylate; methanol / dimethyl sulfoxide / 4 h / 100 °C

With methanol; hydroxylamine hydrochloride; sodium methylate; In dimethyl sulfoxide; N,N-dimethyl-formamide;

Reference yield: 40.0%

(Z)-N'-hydroxy-2-(3-nitrophenyl)acetimidamide (1028344-62-8) + ethyl chlorocarbonylacetate (36239-09-5) → C13H13N3O5 (1028344-73-1)

Guidance literature:

(Z)-N'-hydroxy-2-(3-nitrophenyl)acetimidamide; With sodium hydride; In toluene; mineral oil; at 20 ℃; for 1h; Inert atmosphere;

ethyl chlorocarbonylacetate; In toluene; mineral oil; Inert atmosphere; Reflux;

DOI:10.1021/jm701613h

upstream raw materials:

(3-nitrophenyl)acetonitrile

1-bromomethyl-3-nitrobenzene

Downstream raw materials:

C₁₃H₁₃N₃O₅

5-methyl-3-(3-nitrobenzyl)-1,2,4-oxadiazole

3-((5-methyl-1,2,4-oxadiazol-3-yl)methyl)aniline

2,2,2-trifluoro-N-(3-((5-methyl-1,2,4-oxadiazol-3-yl)methyl)phenyl)acetamide

Refernces

• 1、 La Motta, Concettina,Sartini, Stefania,Salerno, Silvia,Simorini, Francesca,Taliani, Sabrina,Marini, Anna Maria,Da Settimo, Federico,Marinelli, Luciana,Limongelli, Vittorio,Novellino, Ettore. "Acetic acid aldose reductase inhibitors bearing a five-membered heterocyclic core with potent topical activity in a visual impairment rat model". supporting information; experimental part. p. 3182 - 3193. Retrieved 2009/04/06.