4-(4-Chlorophenyl)-4-oxo-2-piperidin-1-ylbutanoic acid

Base Information

• Chemical Name: 4-(4-Chlorophenyl)-4-oxo-2-piperidin-1-ylbutanoic acid
• CAS No.: 70596-75-7
• Molecular Formula: C₁₅H₁₈ClNO₃
• Molecular Weight: 295.766
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID40990815
• Mol file: 70596-75-7.mol

Synonyms:70596-75-7;4-(4-chlorophenyl)-4-oxo-2-piperidin-1-ylbutanoic acid;4-(4-CHLOROPHENYL)-4-OXO-2-(PIPERIDIN-1-YL)BUTANOIC ACID;alpha-(2-(4-Chlorophenyl)-2-oxoethyl)-1-piperidineacetic acid hydrate (2:1);1-Piperidineacetic acid, alpha-(2-(4-chlorophenyl)-2-oxoethyl)-, hydrate (2:1);alpha-(2-(4-Chlorophenyl)-2-oxoethyl)-1-piperidineacetic acid hydrate (2;C15H18ClNO3.1/2H2O;C15-H18-Cl-N-O3.1/2H2-O;DTXSID40990815;AKOS025397048;LS-114096;CS-0366358

Chemical Property of 4-(4-Chlorophenyl)-4-oxo-2-piperidin-1-ylbutanoic acid

Chemical Property:

• Vapor Pressure: 2.11E-10mmHg at 25°C
• Melting Point: 184-185 °C(Solv: benzene (71-43-2); ethanol (64-17-5))
• Boiling Point: 489.6°C at 760 mmHg
• PKA: 2.21±0.23(Predicted)
• Flash Point: 249.9°C
• PSA: 57.61000
• Density: 1.274g/cm³
• LogP: 2.78980
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 295.0975211
• Heavy Atom Count: 20
• Complexity: 347

Purity/Quality:

99%, ^*data from raw suppliers

4-(4-Chlorophenyl)-4-oxo-2-piperidin-1-ylbutanoic acid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O

Technology Process of 4-(4-Chlorophenyl)-4-oxo-2-piperidin-1-ylbutanoic acid

There total 1 articles about 4-(4-Chlorophenyl)-4-oxo-2-piperidin-1-ylbutanoic acid 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:

→ 4-(4-chloro-phenyl)-4-oxo-2-piperidin-1-yl-butyric acid (70596-75-7)

Guidance literature:

Acrylsaeure (I), Piperidin;