N-(4-Chlorobenzoyl)-L-proline

Base Information

• Chemical Name: N-(4-Chlorobenzoyl)-L-proline
• CAS No.: 62522-91-2
• Molecular Formula: C12H12ClNO3
• Molecular Weight: 253.68
• DSSTox Substance ID: DTXSID10364221
• Nikkaji Number: J1.332.635E
• Wikidata: Q82148057

Synonyms:N-(4-Chlorobenzoyl)-L-proline;62522-91-2;(2S)-1-(4-chlorobenzoyl)pyrrolidine-2-carboxylic acid;(S)-1-(4-Chlorobenzoyl)pyrrolidine-2-carboxylic acid;1-(4-Chlorobenzoyl)-L-proline;DTXSID10364221;MFCD09757502;AKOS010372681

Chemical Property of N-(4-Chlorobenzoyl)-L-proline

Chemical Property:

• Vapor Pressure: 1.27E-09mmHg at 25°C
• Boiling Point: 469.6°C at 760 mmHg
• PKA: 5.24±0.10(Predicted)
• Flash Point: 237.8°C
• PSA: 57.61000
• Density: 1.401g/cm³
• LogP: 1.96710
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 253.0505709
• Heavy Atom Count: 17
• Complexity: 313

Purity/Quality:

99% ^*data from raw suppliers

1-(4-Chlorobenzoyl)proline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(N(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O
• Isomeric SMILES: C1C[C@H](N(C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O

Technology Process of N-(4-Chlorobenzoyl)-L-proline

There total 3 articles about N-(4-Chlorobenzoyl)-L-proline 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:

→ N-(4-chlorobenzoyl)proline (62522-91-2)

Guidance literature:

L-Prolin, p-Chlor-benzoylchlorid/Na2CO3;

DOI:10.1021/jm00216a014

Reference yield:

→ cis-N-p-Chlorbenzoyl-prolin (62522-91-2)

Guidance literature:

p-Chlorbenzoylchlorid, 1.) Prolin-methylester, 2.) Verseifung;

DOI:10.1016/0040-4020(76)85206-4

Reference yield:

→ trans-N-p-Chlorbenzoyl-prolin (62522-91-2)

Guidance literature:

p-Chlorbenzoylchlorid, 1.) Prolin-methylester, 2.) Verseifung;

DOI:10.1016/0040-4020(76)85206-4

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