Ethyl 2,2-diethoxyacetimidate

Base Information

• Chemical Name: Ethyl 2,2-diethoxyacetimidate
• CAS No.: 71648-28-7
• Molecular Formula: C8H17 N O3
• Molecular Weight: 175.228
• European Community (EC) Number: 275-757-5
• DSSTox Substance ID: DTXSID30992222
• Nikkaji Number: J298.989A
• Wikidata: Q82982276
• Mol file: 71648-28-7.mol

Synonyms:Ethyl 2,2-diethoxyacetimidate;71648-28-7;ethyl 2,2-diethoxyethanimidate;EINECS 275-757-5;ethyl2,2-diethoxyacetimidate;DTXSID30992222;AT11740;2,2-Diethoxyethanimidic acid ethyl ester;ETHYL 2,2-DIETHOXYETHANECARBOXIMIDATE;FT-0726356;EN300-345768

Chemical Property of Ethyl 2,2-diethoxyacetimidate

Chemical Property:

• Vapor Pressure: 1.14mmHg at 25°C
• Boiling Point: 181.8°C at 760 mmHg
• Flash Point: 63.7°C
• PSA: 51.54000
• Density: 1g/cm³
• LogP: 1.49900
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 175.12084340
• Heavy Atom Count: 12
• Complexity: 122

Purity/Quality:

99% ^*data from raw suppliers

Ethyl2,2-diethoxyacetimidate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(C(=N)OCC)OCC

Technology Process of Ethyl 2,2-diethoxyacetimidate

There total 3 articles about Ethyl 2,2-diethoxyacetimidate 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: 36.0%

2,2-diethoxyacetonitrile (6136-93-2) → ethyl 2,2-diethoxyethanimidate (71648-28-7)

Guidance literature:

With ethanol; sodium; at 20 ℃;

DOI:10.1021/acs.orglett.5b00383

Reference yield:

diethoxyacetamide (61189-99-9) → ethyl 2,2-diethoxyethanimidate (71648-28-7)

Guidance literature:

Multi-step reaction with 2 steps

1: P₂O₅; quinoline

2: alcoholic HCl / 0 °C / Zerlegung des entstandenen Hydrochlorids mit K₂CO₃-Loesung bei -5grad

With quinoline; hydrogenchloride; phosphorus pentoxide;

DOI:10.1111/j.1447-0756.2000.tb01325.x

Reference yield:

Ethyl diethoxyacetate (6065-82-3) → ethyl 2,2-diethoxyethanimidate (71648-28-7)

Guidance literature:

Multi-step reaction with 3 steps

1: concentrated NH₃

2: P₂O₅; quinoline

3: alcoholic HCl / 0 °C / Zerlegung des entstandenen Hydrochlorids mit K₂CO₃-Loesung bei -5grad

With quinoline; hydrogenchloride; ammonium hydroxide; phosphorus pentoxide;

DOI:10.1111/j.1447-0756.2000.tb01325.x

upstream raw materials:

2,2-diethoxyacetonitrile

diethoxyacetamide

Ethyl diethoxyacetate

Downstream raw materials:

2,2-diethoxyacetonitrile

diethoxyacetamide

pentaethoxyethane

Ethyl diethoxyacetate