4-(Trifluoromethylsulfonyl)anisole
TL;DR: 4-(Trifluoromethylsulfonyl)anisole (CAS 15183-74-1) is a chemical compound with molecular formula C8H7F3O3S and molecular weight 240.0068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-4-(trifluoromethylsulfonyl)benzene
Also Known As: 4-(Trifluoromethylsulfonyl)anisole, 1-Methoxy-4-trifluoromethanesulfonyl-benzene, 1-methoxy-4-(trifluoromethylsulfonyl)benzene, 1-Methoxy-4-((trifluoromethyl)sulfonyl)benzene, p-Methoxyphenyl-trifluormethyl-sulfon
Technical Specifications
| Molecular Formula | C8H7F3O3S |
| Molecular Weight | 240.0068 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.0068 Da |
| Heavy Atoms | 15 |
| Complexity | 296.0 |
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)C(F)(F)F |
| InChIKey | YZMRPUPSJOQDBS-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Trifluoromethylsulfonyl)anisole
Property Insights of 4-(Trifluoromethylsulfonyl)anisole
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Trifluoromethylsulfonyl)anisole. With a topological polar surface area (TPSA) of 51.8 Ų, 4-(Trifluoromethylsulfonyl)anisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Trifluoromethylsulfonyl)anisole has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Trifluoromethylsulfonyl)anisole?
The CAS number of 4-(Trifluoromethylsulfonyl)anisole is 15183-74-1.
What is the molecular formula of 4-(Trifluoromethylsulfonyl)anisole?
The molecular formula of 4-(Trifluoromethylsulfonyl)anisole is C8H7F3O3S.
What is the molecular weight of 4-(Trifluoromethylsulfonyl)anisole?
The molecular weight of 4-(Trifluoromethylsulfonyl)anisole is 240.0068 g/mol.
Where can I buy 4-(Trifluoromethylsulfonyl)anisole?
You can request a quote for 4-(Trifluoromethylsulfonyl)anisole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Trifluoromethylsulfonyl)anisole?
Yes, CoreyChem provides custom synthesis services for 4-(Trifluoromethylsulfonyl)anisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.