1-Fluoro-2,6-dichloropyridinium Triflate
TL;DR: 1-Fluoro-2,6-dichloropyridinium Triflate (CAS 130433-68-0) is a chemical compound with molecular formula C6H3Cl2F4NO3S and molecular weight 314.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dichloro-1-fluoropyridin-1-ium;trifluoromethanesulfonate
Also Known As: 1-Fluoro-2,6-dichloropyridinium Triflate, starbld0018787, 2,6-Dichloro-1-fluoropyridinium Triflate, 2,6-Dichloro-1-fluoropyridin-1-ium trifluoromethanesulfonate, n-fluoro-2,6-dichloropyridinium triflate
| Molecular Formula | C6H3Cl2F4NO3S |
|---|---|
| Molecular Weight | 314.91 g/mol |
| LogP | 2.0649 |
| Topological Polar Surface Area | 61.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 314.91467 |
| Heavy Atoms | 17 |
| Complexity | 470.27414 |
Chemical Identifiers
| CAS Number | 130433-68-0 |
|---|---|
| SMILES | C1=CC(=[N+](C(=C1)Cl)F)Cl.C(F)(F)(F)S(=O)(=O)[O-] |
Product Overview
1-Fluoro-2,6-dichloropyridinium Triflate (CAS 130433-68-0), with molecular formula C6H3Cl2F4NO3S and molecular weight 314.91 g/mol. IUPAC: 2,6-dichloro-1-fluoropyridin-1-ium;trifluoromethanesulfonate.
Chemical Property Profile of 1-Fluoro-2,6-dichloropyridinium Triflate
Property Insights of 1-Fluoro-2,6-dichloropyridinium Triflate
The XLogP value of 2.0649 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Fluoro-2,6-dichloropyridinium Triflate. The TPSA of 61.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Fluoro-2,6-dichloropyridinium Triflate. Following Lipinski's Rule of Five, 1-Fluoro-2,6-dichloropyridinium Triflate 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
Frequently Asked Questions
What is the CAS number of 1-Fluoro-2,6-dichloropyridinium Triflate?
The CAS number of 1-Fluoro-2,6-dichloropyridinium Triflate is 130433-68-0.
What is the molecular formula of 1-Fluoro-2,6-dichloropyridinium Triflate?
The molecular formula of 1-Fluoro-2,6-dichloropyridinium Triflate is C6H3Cl2F4NO3S.
What is the molecular weight of 1-Fluoro-2,6-dichloropyridinium Triflate?
The molecular weight of 1-Fluoro-2,6-dichloropyridinium Triflate is 314.91 g/mol.
Where can I buy 1-Fluoro-2,6-dichloropyridinium Triflate?
You can request a quote for 1-Fluoro-2,6-dichloropyridinium Triflate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Fluoro-2,6-dichloropyridinium Triflate?
Yes, KEHONG BIO provides custom synthesis services for 1-Fluoro-2,6-dichloropyridinium Triflate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.