(S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine
TL;DR: (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine (CAS 1213140-29-4) is a chemical compound with molecular formula C11H12F3NO and molecular weight 231.0871 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[3-(trifluoromethoxy)phenyl]pyrrolidine
Also Known As: (2R)-2-[3-(trifluoromethoxy)phenyl]pyrrolidine, (2S)-2-[3-(trifluoromethoxy)phenyl]pyrrolidine, (S)-2-(3-(TRIFLUOROMETHOXY)PHENYL)PYRROLIDINE
Technical Specifications
| Molecular Formula | C11H12F3NO |
| Molecular Weight | 231.0871 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.0871 Da |
| Heavy Atoms | 16 |
| Complexity | 232.0 |
| SMILES | C1C[C@H](NC1)C2=CC(=CC=C2)OC(F)(F)F |
| InChIKey | SDVTXUXMZFMOFC-JTQLQIEISA-N |
Chemical Property Profile of (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine
Property Insights of (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine
The XLogP value of 3.0 indicates that (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine?
The CAS number of (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine is 1213140-29-4.
What is the molecular formula of (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine?
The molecular formula of (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine is C11H12F3NO.
What is the molecular weight of (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine?
The molecular weight of (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine is 231.0871 g/mol.
Where can I buy (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine?
You can request a quote for (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine?
Yes, CoreyChem provides custom synthesis services for (S)-2-(3-(Trifluoromethoxy)phenyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.