Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1)
TL;DR: Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) (CAS 70424-93-0) is a chemical compound with molecular formula C17H22F3NO4 and molecular weight 361.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxalic acid;1-propyl-3-[3-(trifluoromethyl)phenyl]piperidine
Also Known As: N-Propyl-3-(m-trifluoromethylphenyl)piperidine oxalate, 1-Propyl-3-(3-(trifluoromethyl)phenyl)piperidine ethanedioate (1:1), Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1), oxalic acid; 1-propyl-3-[3-(trifluoromethyl)phenyl]piperidine, Oxalic acid--1-propyl-3-[3-(trifluoromethyl)phenyl]piperidine (1/1)
| Molecular Formula | C17H22F3NO4 |
|---|---|
| Molecular Weight | 361.15 g/mol |
| LogP | 3.4504 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.1501 |
| Heavy Atoms | 25 |
| Complexity | 575.50085 |
Chemical Identifiers
| CAS Number | 70424-93-0 |
|---|---|
| SMILES | CCCN1CCCC(C1)C2=CC(=CC=C2)C(F)(F)F.C(=O)(C(=O)O)O |
Product Overview
Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) (CAS 70424-93-0), with molecular formula C17H22F3NO4 and molecular weight 361.15 g/mol. IUPAC: oxalic acid;1-propyl-3-[3-(trifluoromethyl)phenyl]piperidine.
Chemical Property Profile of Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1)
Property Insights of Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1)
The XLogP value of 3.4504 indicates that Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.84 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1). Following Lipinski's Rule of Five, Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) has 2 hydrogen bond donor(s) and 3 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 Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1)?
The CAS number of Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) is 70424-93-0.
What is the molecular formula of Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1)?
The molecular formula of Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) is C17H22F3NO4.
What is the molecular weight of Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1)?
The molecular weight of Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) is 361.15 g/mol.
Where can I buy Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1)?
You can request a quote for Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Piperidine, 1-propyl-3-(3-(trifluoromethyl)phenyl)-, ethanedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.