![1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one structure](/static/products/5322/53226-55-4.webp)
1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one
TL;DR: 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one (CAS 53226-55-4) is a chemical compound with molecular formula C11H10F3NO and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one
Also Known As: 1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one, Maybridge1_006240, 1-(3-(trifluoromethyl)phenyl)pyrrolidin-2-one, BAS 00821067, 1-(m-trifluoromethylphenyl)-2-pyrrolidone
| Molecular Formula | C11H10F3NO |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.07144 |
| Heavy Atoms | 16 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 53226-55-4 |
|---|---|
| SMILES | C1CC(=O)N(C1)C2=CC=CC(=C2)C(F)(F)F |
| InChIKey | LAJKVKMHNNEDGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one (CAS 53226-55-4), with molecular formula C11H10F3NO and molecular weight 229.07 g/mol. IUPAC: 1-[3-(trifluoromethyl)phenyl]pyrrolidin-2-one.
Chemical Property Profile of 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one
Property Insights of 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one. With a topological polar surface area (TPSA) of 20.3 Ų, 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one has 0 hydrogen bond donor(s) and 4 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-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one?
The CAS number of 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one is 53226-55-4.
What is the molecular formula of 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one?
The molecular formula of 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one is C11H10F3NO.
What is the molecular weight of 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one?
The molecular weight of 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one is 229.07 g/mol.
Where can I buy 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one?
You can request a quote for 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(Trifluoromethyl)phenyl]pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.