![1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one structure](/static/products/4782/478261-83-5.webp)
1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one
TL;DR: 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one (CAS 478261-83-5) is a chemical compound with molecular formula C13H11F6NO and molecular weight 311.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one
Also Known As: Bionet2_000873, 1-[3,5-bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one, 9L-715, 1-[3,5-bis(trifluoromethyl)phenyl]-3,3-dimethyl-2-azetanone, 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethyl-2-azetidinone
| Molecular Formula | C13H11F6NO |
|---|---|
| Molecular Weight | 311.07 g/mol |
| LogP | 4.097 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 311.0745 |
| Heavy Atoms | 21 |
| Complexity | 555.05475 |
Chemical Identifiers
| CAS Number | 478261-83-5 |
|---|---|
| SMILES | CC1(CN(C1=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C |
Product Overview
1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one (CAS 478261-83-5), with molecular formula C13H11F6NO and molecular weight 311.07 g/mol. IUPAC: 1-[3,5-bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one.
Chemical Property Profile of 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one
Property Insights of 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one
The XLogP value of 4.097 indicates that 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one has 0 hydrogen bond donor(s) and 1 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-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one?
The CAS number of 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one is 478261-83-5.
What is the molecular formula of 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one?
The molecular formula of 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one is C13H11F6NO.
What is the molecular weight of 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one?
The molecular weight of 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one is 311.07 g/mol.
Where can I buy 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one?
You can request a quote for 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-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-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[3,5-Bis(trifluoromethyl)phenyl]-3,3-dimethylazetidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.