Ethyl beta-amino-beta-ethoxyacrylate hydrochloride

Base Information

• Chemical Name: Ethyl beta-amino-beta-ethoxyacrylate hydrochloride
• CAS No.: 34570-16-6
• Molecular Formula: C7H13NO3^.HCl
• Molecular Weight: 195.646
• Hs Code.: 2922509090
• Mol file: 34570-16-6.mol

Synonyms:Ethyl 3-amino-3-ethoxyacrylate HCl;SCHEMBL1145441;(1,3-diethoxy-3-oxoprop-1-enyl)ammonium chloride;JYGHNNMPKVPTKF-UHFFFAOYSA-N;ethyl 3-amino-3-ethoxy-acrylate HCl;FT-0604496;(E)-ethyl 3-amino-3-ethoxyacrylate hydrochloride;ethyl beta-amino-beta-ethoxyacrylate hydrochloride

Chemical Property of Ethyl beta-amino-beta-ethoxyacrylate hydrochloride

Chemical Property:

• Vapor Pressure: 0.0114mmHg at 25°C
• Melting Point: 103-105 °C(lit.)
• Boiling Point: 261.7 °C at 760 mmHg
• Flash Point: 118.7 °C
• PSA: 61.55000
• LogP: 1.88840
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 195.0662210
• Heavy Atom Count: 12
• Complexity: 154

Purity/Quality:

99% ^*data from raw suppliers

Ethyl 3-Amino-3-ethoxyacrylate Hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=CC(=O)OCC)N.Cl
• Uses: Ethyl 3-Amino-3-ethoxyacrylate Hydrochloride is used as a reagent in the synthesis of pyridine carboxamides as c-Jun NH2-terminal kinase inhibitors. Ethyl 3-amino-3-ethoxyacrylate hydrochloride may be used in chemical synthesis.

Technology Process of Ethyl beta-amino-beta-ethoxyacrylate hydrochloride

There total 3 articles about Ethyl beta-amino-beta-ethoxyacrylate hydrochloride 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: 90.0%

ethanol (64-17-5) + ethyl 2-cyanoacetate (105-56-6) → ethyl 3-amino-3-ethoxyacrylate hydrochloride (34570-16-6)

Guidance literature:

With hydrogenchloride; at 0 ℃;

DOI:10.1002/hlca.19830660313

Reference yield:

ethanol (64-17-5) + ethyl 2-cyanoacetate (105-56-6) → ethyl β-amino-β-ethoxyacrylate hydrochloride (34570-16-6)

Guidance literature:

With hydrogenchloride; In diethyl ether; at 0 ℃; for 24h;

Reference yield:

tert-butyl methyl ether (1634-04-4) + ethyl 2-cyanoacetate (105-56-6) → ethyl 3-amino-3-ethoxyacrylate hydrochloride (34570-16-6)

Guidance literature:

With hydrogenchloride; In ethanol;

upstream raw materials:

ethanol

ethyl 2-cyanoacetate

tert-butyl methyl ether

Downstream raw materials:

C₁₃H₁₆ClN₃O₅

ethyl 2-(benzo[e][1,2,4]triazin-3-yl)acetate

5-Amino-1,2-dihydro-1-methyl-2-phenylpyrazol-3-one

5-amino-2,4-dihydro-2-(4-trifluoromethylphenyl)-3H-pyrazol-3-one

Refernces

• 1、 -. "PYRANO-QUINOLINES, PYRANO-QUINOLINONES, COMBINATIONS THEREOF, PHOTOCHROMIC COMPOSITIONS AND ARTICLES". Page/Page column 42. . Retrieved 2010/02/12.
• 2、 Muller, Jean-Claude,Ramuz, Henri,Wagner, Hans-Peter. "80. A New Route to the Synthesis of 2-Amino-6-(methoxycarbonyl)amino-4-(tetrahydropyridyl)pyrimidine 1-Oxide". . p. 809 - 813. Retrieved 2007/10/02.