1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid
TL;DR: 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid (CAS 451485-54-4) is a chemical compound with molecular formula C13H15Cl2NO2 and molecular weight 287.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dichlorophenyl)methyl]piperidine-4-carboxylic acid
Also Known As: 1-(3,4-dichlorobenzyl)piperidine-4-carboxylic acid, 1-(3,4-DICHLORO-BENZYL)-PIPERIDINE-4-CARBOXYLIC ACID, 1-[(3,4-dichlorophenyl)methyl]piperidine-4-carboxylic Acid, ETHYLENEGLYCOLDI-N-BUTYLETHER, 4523AH
| Molecular Formula | C13H15Cl2NO2 |
|---|---|
| Molecular Weight | 287.05 g/mol |
| LogP | 3.29 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.04797 |
| Heavy Atoms | 18 |
| Complexity | 442.61743 |
Chemical Identifiers
| CAS Number | 451485-54-4 |
|---|---|
| SMILES | C1CN(CCC1C(=O)O)CC2=CC(=C(C=C2)Cl)Cl |
Product Overview
1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid (CAS 451485-54-4), with molecular formula C13H15Cl2NO2 and molecular weight 287.05 g/mol. IUPAC: 1-[(3,4-dichlorophenyl)methyl]piperidine-4-carboxylic acid.
Chemical Property Profile of 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid
Property Insights of 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid
The XLogP value of 3.29 indicates that 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.54 Ų, 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dichlorobenzyl)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-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid?
The CAS number of 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid is 451485-54-4.
What is the molecular formula of 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid?
The molecular formula of 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid is C13H15Cl2NO2.
What is the molecular weight of 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid?
The molecular weight of 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid is 287.05 g/mol.
Where can I buy 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid?
You can request a quote for 1-(3,4-Dichlorobenzyl)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-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dichlorobenzyl)piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.