1-(2-Chloroacetyl)piperidine-4-carboxylic acid
TL;DR: 1-(2-Chloroacetyl)piperidine-4-carboxylic acid (CAS 318280-69-2) is a chemical compound with molecular formula C8H12ClNO3 and molecular weight 205.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroacetyl)piperidine-4-carboxylic acid
Also Known As: N-Chloroacetylisonipecotic acid, 1-(2-chloroacetyl)piperidine-4-carboxylic Acid, MurA-IN-4, Hexafluoroglutarylchloride, N-Chloroacetyl-DL-isonipecotic acid
| Molecular Formula | C8H12ClNO3 |
|---|---|
| Molecular Weight | 205.05 g/mol |
| LogP | 0.5484 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.05057 |
| Heavy Atoms | 13 |
| Complexity | 211.43468 |
Chemical Identifiers
| CAS Number | 318280-69-2 |
|---|---|
| SMILES | C1CN(CCC1C(=O)O)C(=O)CCl |
Product Overview
1-(2-Chloroacetyl)piperidine-4-carboxylic acid (CAS 318280-69-2), with molecular formula C8H12ClNO3 and molecular weight 205.05 g/mol. IUPAC: 1-(2-chloroacetyl)piperidine-4-carboxylic acid.
Chemical Property Profile of 1-(2-Chloroacetyl)piperidine-4-carboxylic acid
Property Insights of 1-(2-Chloroacetyl)piperidine-4-carboxylic acid
The XLogP value of 0.5484 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroacetyl)piperidine-4-carboxylic acid. With a topological polar surface area (TPSA) of 57.61 Ų, 1-(2-Chloroacetyl)piperidine-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroacetyl)piperidine-4-carboxylic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-Chloroacetyl)piperidine-4-carboxylic acid?
The CAS number of 1-(2-Chloroacetyl)piperidine-4-carboxylic acid is 318280-69-2.
What is the molecular formula of 1-(2-Chloroacetyl)piperidine-4-carboxylic acid?
The molecular formula of 1-(2-Chloroacetyl)piperidine-4-carboxylic acid is C8H12ClNO3.
What is the molecular weight of 1-(2-Chloroacetyl)piperidine-4-carboxylic acid?
The molecular weight of 1-(2-Chloroacetyl)piperidine-4-carboxylic acid is 205.05 g/mol.
Where can I buy 1-(2-Chloroacetyl)piperidine-4-carboxylic acid?
You can request a quote for 1-(2-Chloroacetyl)piperidine-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chloroacetyl)piperidine-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloroacetyl)piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.