1-(2,6-Difluorobenzyl)pyridinium bromide
TL;DR: 1-(2,6-Difluorobenzyl)pyridinium bromide (CAS 646497-96-3) is a chemical compound with molecular formula C12H10BrF2N and molecular weight 285.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2,6-difluorophenyl)methyl]pyridin-1-ium bromide
Also Known As: 1-(2,6-difluorobenzyl)pyridinium bromide, 1-[(2,6-difluorophenyl)methyl]pyridin-1-ium bromide, 1-(2,6-DIFLUOROBENZYL)PYRIDINIUMBROMIDE, 1-[(2,6-difluorophenyl)methyl]pyridine Bromide, 1-[(2,6-difluorophenyl)methyl]pyridin-1-ium;bromide
| Molecular Formula | C12H10BrF2N |
|---|---|
| Molecular Weight | 285.00 g/mol |
| LogP | -0.6954 |
| Topological Polar Surface Area | 3.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.99646 |
| Heavy Atoms | 16 |
| Complexity | 439.58087 |
Chemical Identifiers
| CAS Number | 646497-96-3 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)CC2=C(C=CC=C2F)F.[Br-] |
Product Overview
1-(2,6-Difluorobenzyl)pyridinium bromide (CAS 646497-96-3), with molecular formula C12H10BrF2N and molecular weight 285.00 g/mol. IUPAC: 1-[(2,6-difluorophenyl)methyl]pyridin-1-ium bromide.
Chemical Property Profile of 1-(2,6-Difluorobenzyl)pyridinium bromide
Property Insights of 1-(2,6-Difluorobenzyl)pyridinium bromide
The XLogP value of -0.6954 indicates that 1-(2,6-Difluorobenzyl)pyridinium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.88 Ų, 1-(2,6-Difluorobenzyl)pyridinium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,6-Difluorobenzyl)pyridinium bromide has 0 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 1-(2,6-Difluorobenzyl)pyridinium bromide?
The CAS number of 1-(2,6-Difluorobenzyl)pyridinium bromide is 646497-96-3.
What is the molecular formula of 1-(2,6-Difluorobenzyl)pyridinium bromide?
The molecular formula of 1-(2,6-Difluorobenzyl)pyridinium bromide is C12H10BrF2N.
What is the molecular weight of 1-(2,6-Difluorobenzyl)pyridinium bromide?
The molecular weight of 1-(2,6-Difluorobenzyl)pyridinium bromide is 285.00 g/mol.
Where can I buy 1-(2,6-Difluorobenzyl)pyridinium bromide?
You can request a quote for 1-(2,6-Difluorobenzyl)pyridinium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,6-Difluorobenzyl)pyridinium bromide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Difluorobenzyl)pyridinium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.