1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine
TL;DR: 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine (CAS 321970-45-0) is a chemical compound with molecular formula C7H12F3NO2S and molecular weight 231.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfonyl-3-(trifluoromethyl)piperidine
Also Known As: 1-(methylsulfonyl)-3-(trifluoromethyl)piperidine, 1-methylsulfonyl-3-(trifluoromethyl)piperidine
| Molecular Formula | C7H12F3NO2S |
|---|---|
| Molecular Weight | 231.05 g/mol |
| LogP | 1.2203 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.05408 |
| Heavy Atoms | 14 |
| Complexity | 298.547 |
Chemical Identifiers
| CAS Number | 321970-45-0 |
|---|---|
| SMILES | CS(=O)(=O)N1CCCC(C1)C(F)(F)F |
Product Overview
1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine (CAS 321970-45-0), with molecular formula C7H12F3NO2S and molecular weight 231.05 g/mol. IUPAC: 1-methylsulfonyl-3-(trifluoromethyl)piperidine.
Chemical Property Profile of 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine
Property Insights of 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine
The XLogP value of 1.2203 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine. With a topological polar surface area (TPSA) of 37.38 Ų, 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine 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 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine?
The CAS number of 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine is 321970-45-0.
What is the molecular formula of 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine?
The molecular formula of 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine is C7H12F3NO2S.
What is the molecular weight of 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine?
The molecular weight of 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine is 231.05 g/mol.
Where can I buy 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine?
You can request a quote for 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Methylsulfonyl)-3-(trifluoromethyl)piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.