3-(Trifluoromethoxy)anisole
TL;DR: 3-(Trifluoromethoxy)anisole (CAS 142739-37-5) is a chemical compound with molecular formula C8H7F3O2 and molecular weight 192.03981 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-3-(trifluoromethoxy)benzene
Also Known As: 3-(Trifluoromethoxy)anisole, 1-Methoxy-3-(trifluoromethoxy)Benzene, 3-trifluoromethoxyanisole, 3- ANISOLE, 5,7-dibromo-2-tetralone
Technical Specifications
| Molecular Formula | C8H7F3O2 |
| Molecular Weight | 192.03981 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.03981 Da |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
| SMILES | COC1=CC(=CC=C1)OC(F)(F)F |
| InChIKey | OKSRAPDSZKICKZ-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Trifluoromethoxy)anisole
Property Insights of 3-(Trifluoromethoxy)anisole
The XLogP value of 3.4 indicates that 3-(Trifluoromethoxy)anisole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 3-(Trifluoromethoxy)anisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Trifluoromethoxy)anisole has 0 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 3-(Trifluoromethoxy)anisole?
The CAS number of 3-(Trifluoromethoxy)anisole is 142739-37-5.
What is the molecular formula of 3-(Trifluoromethoxy)anisole?
The molecular formula of 3-(Trifluoromethoxy)anisole is C8H7F3O2.
What is the molecular weight of 3-(Trifluoromethoxy)anisole?
The molecular weight of 3-(Trifluoromethoxy)anisole is 192.03981 g/mol.
Where can I buy 3-(Trifluoromethoxy)anisole?
You can request a quote for 3-(Trifluoromethoxy)anisole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Trifluoromethoxy)anisole?
Yes, CoreyChem provides custom synthesis services for 3-(Trifluoromethoxy)anisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.