![3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one structure](/static/products/3390/339015-91-7.webp)
3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one
TL;DR: 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one (CAS 339015-91-7) is a chemical compound with molecular formula C12H12F3NO and molecular weight 243.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one
Also Known As: Bionet2_001003, 3,3-dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one, 3,3-dimethyl-1-[4-(trifluoromethyl)phenyl]-2-azetanone, 7L-745
| Molecular Formula | C12H12F3NO |
|---|---|
| Molecular Weight | 243.09 g/mol |
| LogP | 3.0782 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.0871 |
| Heavy Atoms | 17 |
| Complexity | 447.8137 |
Chemical Identifiers
| CAS Number | 339015-91-7 |
|---|---|
| SMILES | CC1(CN(C1=O)C2=CC=C(C=C2)C(F)(F)F)C |
Product Overview
3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one (CAS 339015-91-7), with molecular formula C12H12F3NO and molecular weight 243.09 g/mol. IUPAC: 3,3-dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one.
Chemical Property Profile of 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one
Property Insights of 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one
The XLogP value of 3.0782 indicates that 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-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, 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-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 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one?
The CAS number of 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one is 339015-91-7.
What is the molecular formula of 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one?
The molecular formula of 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one is C12H12F3NO.
What is the molecular weight of 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one?
The molecular weight of 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one is 243.09 g/mol.
Where can I buy 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one?
You can request a quote for 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyl-1-[4-(trifluoromethyl)phenyl]azetidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.