Ethyl 4-(benzoylamino)-2-(diethoxyphosphinyl)butanoate

Base Information

• Chemical Name: Ethyl 4-(benzoylamino)-2-(diethoxyphosphinyl)butanoate
• CAS No.: 167871-42-3
• Molecular Formula: C₁₇H₂₆NO₆P
• Molecular Weight: 371.37
• DSSTox Substance ID: DTXSID501211792
• Nikkaji Number: J650.426D

Synonyms:DTXSID501211792;167871-42-3;Ethyl 4-(benzoylamino)-2-(diethoxyphosphinyl)butanoate

Chemical Property of Ethyl 4-(benzoylamino)-2-(diethoxyphosphinyl)butanoate

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 12
• Exact Mass: 371.14977455
• Heavy Atom Count: 25
• Complexity: 454

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(CCNC(=O)C1=CC=CC=C1)P(=O)(OCC)OCC

Technology Process of Ethyl 4-(benzoylamino)-2-(diethoxyphosphinyl)butanoate

There total 1 articles about Ethyl 4-(benzoylamino)-2-(diethoxyphosphinyl)butanoate 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: 62.0%

N-benzoylaziridine (7646-66-4) + diethoxyphosphoryl-acetic acid ethyl ester (867-13-0) → 4-Benzoylamino-2-(diethoxy-phosphoryl)-butyric acid ethyl ester (167871-42-3)

Guidance literature:

With sodium hydride; In tetrahydrofuran; for 48h; Product distribution; other reaction time, other reag.;

DOI:10.1055/s-1995-3843

Reference yield: 58.0%

benzaldehyde (100-52-7) + 4-Benzoylamino-2-(diethoxy-phosphoryl)-butyric acid ethyl ester (167871-42-3) → (E)-3-phenylmethylene-2-pyrrolidinone (1859-41-2,50908-72-0) + (Z)-4-Benzamido-2-benzylidenbuttersaeureethylester + (E)-4-Benzamido-2-benzylidenbuttersaeureethylester

Guidance literature:

With sodium hydride; In tetrahydrofuran; at 20 ℃; for 48h;

Reference yield: 19.0%

acetophenone (98-86-2) + 4-Benzoylamino-2-(diethoxy-phosphoryl)-butyric acid ethyl ester (167871-42-3) → (Z)-3-(α-Methylbenzyliden)-2-pyrrolidon + (E)-3-(α-Methylbenzyliden)-2-pyrrolidon

Guidance literature:

With sodium hydride; In tetrahydrofuran; at 20 ℃; for 480h;

upstream raw materials:

N-benzoylaziridine

diethoxyphosphoryl-acetic acid ethyl ester

Downstream raw materials:

(E)-3-phenylmethylene-2-pyrrolidinone

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