Benzeneselenyl trifalate
TL;DR: Benzeneselenyl trifalate (CAS 1258-86-2) is a chemical compound with molecular formula C7H5F3O3SSe and molecular weight 305.90768 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenylselanyl trifluoromethanesulfonate
Also Known As: Phseotf, Benzeneselenyl trifalate, phenylselenenyl triflate, phenylselanyl trifluoromethanesulfonate, KST-1A0957
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H5F3O3SSe |
| Molecular Weight | 305.90768 g/mol |
| XLogP | 0.7973 |
| Topological Polar Surface Area (TPSA) | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.90768 Da |
| Heavy Atoms | 15 |
| Complexity | 290.0 |
| SMILES | C1=CC=C(C=C1)[Se]OS(=O)(=O)C(F)(F)F |
| InChIKey | WSBBSYJIJBSMBB-UHFFFAOYSA-N |
Chemical Property Profile of Benzeneselenyl trifalate
Property Insights of Benzeneselenyl trifalate
The XLogP value of 0.7973 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzeneselenyl trifalate. With a topological polar surface area (TPSA) of 51.8 Ų, Benzeneselenyl trifalate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneselenyl trifalate 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 Benzeneselenyl trifalate?
The CAS number of Benzeneselenyl trifalate is 1258-86-2.
What is the molecular formula of Benzeneselenyl trifalate?
The molecular formula of Benzeneselenyl trifalate is C7H5F3O3SSe.
What is the molecular weight of Benzeneselenyl trifalate?
The molecular weight of Benzeneselenyl trifalate is 305.90768 g/mol.
Where can I buy Benzeneselenyl trifalate?
You can request a quote for Benzeneselenyl trifalate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzeneselenyl trifalate?
Yes, CoreyChem provides custom synthesis services for Benzeneselenyl trifalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.