1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
TL;DR: 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid (CAS 896046-07-4) 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-3-carboxylic acid
Also Known As: 1-[[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic Acid, 1-[4-(trifluoromethyl)benzyl]piperidine-3-carboxylic acid, 1-(4-Trifluoromethyl-benzyl)-piperidine-3-carboxylic acid 1HCl salt, 1-(4-trifluoromethyl-benzyl)piperidine-3-carboxylic acid hydrochloride
| Molecular Formula | C14H16F3NO2 |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 3.002 |
| 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 | 896046-07-4 |
|---|---|
| SMILES | C1CC(CN(C1)CC2=CC=C(C=C2)C(F)(F)F)C(=O)O |
Product Overview
1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid (CAS 896046-07-4), with molecular formula C14H16F3NO2 and molecular weight 287.11 g/mol. IUPAC: 1-[[4-(trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid.
Chemical Property Profile of 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
Property Insights of 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid
The XLogP value of 3.002 indicates that 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-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-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-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-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid?
The CAS number of 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid is 896046-07-4.
What is the molecular formula of 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid?
The molecular formula of 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid is C14H16F3NO2.
What is the molecular weight of 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid?
The molecular weight of 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid is 287.11 g/mol.
Where can I buy 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid?
You can request a quote for 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-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-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[[4-(Trifluoromethyl)phenyl]methyl]piperidine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.