1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine
TL;DR: 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine (CAS 1042444-54-1) is a chemical compound with molecular formula C14H16F3NO2 and molecular weight 287.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[4-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid
Also Known As: 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine, 1-[[4-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic Acid, 1-(4-(trifluoromethyl)benzyl)piperidine-2-carboxylic
| Molecular Formula | C14H16F3NO2 |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 3.1445 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.1133 |
| Heavy Atoms | 20 |
| Complexity | 470.30252 |
Chemical Identifiers
| CAS Number | 1042444-54-1 |
|---|---|
| SMILES | C1CCN(C(C1)C(=O)O)CC2=CC=C(C=C2)C(F)(F)F |
Product Overview
1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine (CAS 1042444-54-1), with molecular formula C14H16F3NO2 and molecular weight 287.11 g/mol. IUPAC: 1-[[4-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxylic acid.
Chemical Property Profile of 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine
Property Insights of 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine
The XLogP value of 3.1445 indicates that 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine 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-(4-Trifluoromethylbenzyl)-2-carboxypiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine 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-(4-Trifluoromethylbenzyl)-2-carboxypiperidine?
The CAS number of 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine is 1042444-54-1.
What is the molecular formula of 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine?
The molecular formula of 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine is C14H16F3NO2.
What is the molecular weight of 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine?
The molecular weight of 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine is 287.11 g/mol.
Where can I buy 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine?
You can request a quote for 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Trifluoromethylbenzyl)-2-carboxypiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.