Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate
TL;DR: Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate (CAS 166953-64-6) is a chemical compound with molecular formula C13H16BrNO2 and molecular weight 297.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 4-bromopiperidine-1-carboxylate
Also Known As: Benzyl 4-bromopiperidine-1-carboxylate, 4-Bromo-N-Z-piperidine, 1-Cbz-4-bromopiperidine, N-CBZ-4-BROMO-PIPERIDINE, N-Z-4-Bromo-piperidine
| Molecular Formula | C13H16BrNO2 |
|---|---|
| Molecular Weight | 297.04 g/mol |
| LogP | 3.1825 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.03644 |
| Heavy Atoms | 17 |
| Complexity | 360.94202 |
Chemical Identifiers
| CAS Number | 166953-64-6 |
|---|---|
| SMILES | C1CN(CCC1Br)C(=O)OCC2=CC=CC=C2 |
Product Overview
Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate (CAS 166953-64-6), with molecular formula C13H16BrNO2 and molecular weight 297.04 g/mol. IUPAC: benzyl 4-bromopiperidine-1-carboxylate.
Chemical Property Profile of Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate
Property Insights of Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate
The XLogP value of 3.1825 indicates that Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate has 0 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 Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate?
The CAS number of Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate is 166953-64-6.
What is the molecular formula of Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate?
The molecular formula of Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate is C13H16BrNO2.
What is the molecular weight of Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate?
The molecular weight of Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate is 297.04 g/mol.
Where can I buy Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate?
You can request a quote for Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 4-bromotetrahydro-1(2H)-pyridinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.