4-Bromo-4-phenylpiperidin-1-ium bromide
TL;DR: 4-Bromo-4-phenylpiperidin-1-ium bromide (CAS 80866-85-9) is a chemical compound with molecular formula C11H15Br2N and molecular weight 318.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-4-phenylpiperidin-1-ium bromide
Also Known As: 4-bromo-4-phenylpiperidin-1-ium bromide, 4-bromo-4-phenyl-2,3,5,6-tetrahydropyridine Bromide
| Molecular Formula | C11H15Br2N |
|---|---|
| Molecular Weight | 318.96 g/mol |
| LogP | -1.362 |
| Topological Polar Surface Area | 16.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.95712 |
| Heavy Atoms | 14 |
| Complexity | 267.87582 |
Chemical Identifiers
| CAS Number | 80866-85-9 |
|---|---|
| SMILES | C1C[NH2+]CCC1(C2=CC=CC=C2)Br.[Br-] |
Product Overview
4-Bromo-4-phenylpiperidin-1-ium bromide (CAS 80866-85-9), with molecular formula C11H15Br2N and molecular weight 318.96 g/mol. IUPAC: 4-bromo-4-phenylpiperidin-1-ium bromide.
Chemical Property Profile of 4-Bromo-4-phenylpiperidin-1-ium bromide
Property Insights of 4-Bromo-4-phenylpiperidin-1-ium bromide
The XLogP value of -1.362 indicates that 4-Bromo-4-phenylpiperidin-1-ium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 16.61 Ų, 4-Bromo-4-phenylpiperidin-1-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-4-phenylpiperidin-1-ium bromide has 1 hydrogen bond donor(s) and 0 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 4-Bromo-4-phenylpiperidin-1-ium bromide?
The CAS number of 4-Bromo-4-phenylpiperidin-1-ium bromide is 80866-85-9.
What is the molecular formula of 4-Bromo-4-phenylpiperidin-1-ium bromide?
The molecular formula of 4-Bromo-4-phenylpiperidin-1-ium bromide is C11H15Br2N.
What is the molecular weight of 4-Bromo-4-phenylpiperidin-1-ium bromide?
The molecular weight of 4-Bromo-4-phenylpiperidin-1-ium bromide is 318.96 g/mol.
Where can I buy 4-Bromo-4-phenylpiperidin-1-ium bromide?
You can request a quote for 4-Bromo-4-phenylpiperidin-1-ium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-4-phenylpiperidin-1-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-4-phenylpiperidin-1-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.