Perfluoro-N-ethylpiperidine
TL;DR: Perfluoro-N-ethylpiperidine (CAS 307531-76-6) is a chemical compound with molecular formula C13H8F9NO5S and molecular weight 461.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl) 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
Also Known As: Perfluoro-N-ethylpiperidine, N-HYDROXY-5-NORBORNENE-2 3-DICARBOXIMID&, n-hydroxy-5-norbornene-2 3-dicarboximid&, 2-[(1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonyl)oxy]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione, J2.135.201B
| Molecular Formula | C13H8F9NO5S |
|---|---|
| Molecular Weight | 461.00 g/mol |
| LogP | 2.4806 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 460.99796 |
| Heavy Atoms | 29 |
| Complexity | 866.8414 |
Chemical Identifiers
| CAS Number | 307531-76-6 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)OS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
Product Overview
Perfluoro-N-ethylpiperidine (CAS 307531-76-6), with molecular formula C13H8F9NO5S and molecular weight 461.00 g/mol. IUPAC: (3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl) 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate.
Chemical Property Profile of Perfluoro-N-ethylpiperidine
Property Insights of Perfluoro-N-ethylpiperidine
The XLogP value of 2.4806 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perfluoro-N-ethylpiperidine. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Perfluoro-N-ethylpiperidine. Following Lipinski's Rule of Five, Perfluoro-N-ethylpiperidine has 0 hydrogen bond donor(s) and 5 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 Perfluoro-N-ethylpiperidine?
The CAS number of Perfluoro-N-ethylpiperidine is 307531-76-6.
What is the molecular formula of Perfluoro-N-ethylpiperidine?
The molecular formula of Perfluoro-N-ethylpiperidine is C13H8F9NO5S.
What is the molecular weight of Perfluoro-N-ethylpiperidine?
The molecular weight of Perfluoro-N-ethylpiperidine is 461.00 g/mol.
Where can I buy Perfluoro-N-ethylpiperidine?
You can request a quote for Perfluoro-N-ethylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perfluoro-N-ethylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for Perfluoro-N-ethylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.