1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine
TL;DR: 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine (CAS 692279-06-4) is a chemical compound with molecular formula C11H12F3NO2S and molecular weight 279.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(trifluoromethylsulfonyl)phenyl]pyrrolidine
Also Known As: 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine, 4-(TRIFLUOROMETHYLSULFONYL)PHENYL-1-YLPYRROLIDINE, 1-[4-(trifluoromethylsulfonyl)phenyl]pyrrolidine, 1-{4-[(trifluoromethyl)sulfonyl]phenyl}pyrrolidine, 4-(Trifluoromethylsulfonyl)phenyl-1-ylpyrrolidine, 98%
| Molecular Formula | C11H12F3NO2S |
|---|---|
| Molecular Weight | 279.05 g/mol |
| LogP | 2.5803 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.05408 |
| Heavy Atoms | 18 |
| Complexity | 516.2145 |
Chemical Identifiers
| CAS Number | 692279-06-4 |
|---|---|
| SMILES | C1CCN(C1)C2=CC=C(C=C2)S(=O)(=O)C(F)(F)F |
Product Overview
1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine (CAS 692279-06-4), with molecular formula C11H12F3NO2S and molecular weight 279.05 g/mol. IUPAC: 1-[4-(trifluoromethylsulfonyl)phenyl]pyrrolidine.
Chemical Property Profile of 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine
Property Insights of 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine
The XLogP value of 2.5803 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine. With a topological polar surface area (TPSA) of 37.38 Ų, 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine 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-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine?
The CAS number of 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine is 692279-06-4.
What is the molecular formula of 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine?
The molecular formula of 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine is C11H12F3NO2S.
What is the molecular weight of 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine?
The molecular weight of 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine is 279.05 g/mol.
Where can I buy 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine?
You can request a quote for 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-((Trifluoromethyl)sulfonyl)phenyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.