Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate
TL;DR: Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate (CAS 148729-12-8) is a chemical compound with molecular formula C15H20BrNO2 and molecular weight 325.06775 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 1-[(4-bromophenyl)methyl]piperidine-4-carboxylate
Also Known As: ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate, starbld0014320, Ethyl 1-[(4-bromophenyl)methyl]piperidine-4-carboxylate, AB00077738-01
Technical Specifications
| Molecular Formula | C15H20BrNO2 |
| Molecular Weight | 325.06775 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.06775 Da |
| Heavy Atoms | 19 |
| Complexity | 282.0 |
| SMILES | CCOC(=O)C1CCN(CC1)CC2=CC=C(C=C2)Br |
| InChIKey | PQIQRGHWBIXCRP-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate
Property Insights of Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate
The XLogP value of 3.2 indicates that Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate?
The CAS number of Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate is 148729-12-8.
What is the molecular formula of Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate?
The molecular formula of Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate is C15H20BrNO2.
What is the molecular weight of Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate?
The molecular weight of Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate is 325.06775 g/mol.
Where can I buy Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate?
You can request a quote for Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 1-(4-bromobenzyl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.