alpha-Ethoxy-m-nitrobenzylideneammonium chloride

Base Information

• Chemical Name: alpha-Ethoxy-m-nitrobenzylideneammonium chloride
• CAS No.: 57508-53-9
• Molecular Formula: C9H10 N2 O3 . Cl H
• Molecular Weight: 230.651
• European Community (EC) Number: 260-774-2
• DSSTox Substance ID: DTXSID60973044
• Mol file: 57508-53-9.mol

Synonyms:57508-53-9;alpha-Ethoxy-m-nitrobenzylideneammonium chloride;ethyl 3-nitrobenzenecarboximidate;hydrochloride;Ethyl 3-nitrobenzene-1-carboximidate hydrochloride;EINECS 260-774-2;SCHEMBL258587;DTXSID60973044;MFCD14707300;AKOS030614796;Ethyl 3-nitrobenzene-1-carboximidate--hydrogen chloride (1/1)

Chemical Property of alpha-Ethoxy-m-nitrobenzylideneammonium chloride

Chemical Property:

• Boiling Point: 273.6°Cat760mmHg
• Flash Point: 119.3°C
• PSA: 78.90000
• Density: g/cm³
• LogP: 3.38160
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 230.0458199
• Heavy Atom Count: 15
• Complexity: 225

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=N)C1=CC(=CC=C1)[N+](=O)[O-].Cl

Technology Process of alpha-Ethoxy-m-nitrobenzylideneammonium chloride

There total 3 articles about alpha-Ethoxy-m-nitrobenzylideneammonium chloride 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%

ethanol (64-17-5) + 3-nitrobenzonitrile (619-24-9) → 3-nitrobenzenecarboximidic acid ethyl ester monohydrochloride (57508-53-9)

Guidance literature:

With hydrogenchloride; In ethanol;

Reference yield:

ethyl iodide (75-03-6) → 3-nitrobenzenecarboximidic acid ethyl ester monohydrochloride (57508-53-9)

Guidance literature:

at 50 ℃; nachfolgend Zusatz von aether. Chlorwasserstoff;

Reference yield:

hydrogenchloride (7647-01-0,15364-23-5) + ethanol (64-17-5) + 3-nitrobenzonitrile (619-24-9) → 3-nitrobenzenecarboximidic acid ethyl ester monohydrochloride (57508-53-9)

Guidance literature:

upstream raw materials:

ethanol

3-nitrobenzonitrile

hydrogenchloride

ethyl iodide

Downstream raw materials:

1,4-diamino-2-[5-(3-nitro-phenyl)-[1,3,4]oxadiazol-2-yl]-anthraquinone

3-nitro-1-<5'-<5''-(piperidin-1'''-yl)benzimidazol-2''-yl>benzimidazol-2'-yl>benzene

5-(4-methylpiperazin-1-yl)-2'-(3-nitrophenyl)-2,5'-bi-1H-benzimidazole

ethyl 3-nitrobenzoate