Benzeneselenyl trifluoroacetate
TL;DR: Benzeneselenyl trifluoroacetate (CAS 51558-78-2) is a chemical compound with molecular formula C8H5F3O2Se and molecular weight 269.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenylselanyl 2,2,2-trifluoroacetate
Also Known As: phenylselenenyl trifluoroacetate, BENZENESELENYL TRIFLUOROACETATE, Phenylselanyl 2,2,2-trifluoroacetate, OSe-phenyl 2,2,2-trifluoroethane(selenoperoxoate)
| Molecular Formula | C8H5F3O2Se |
|---|---|
| Molecular Weight | 269.94 g/mol |
| LogP | 1.0366 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.9407 |
| Heavy Atoms | 14 |
| Complexity | 310.11246 |
Chemical Identifiers
| CAS Number | 51558-78-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)[Se]OC(=O)C(F)(F)F |
Product Overview
Benzeneselenyl trifluoroacetate (CAS 51558-78-2), with molecular formula C8H5F3O2Se and molecular weight 269.94 g/mol. IUPAC: phenylselanyl 2,2,2-trifluoroacetate.
Chemical Property Profile of Benzeneselenyl trifluoroacetate
Property Insights of Benzeneselenyl trifluoroacetate
The XLogP value of 1.0366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzeneselenyl trifluoroacetate. With a topological polar surface area (TPSA) of 26.3 Ų, Benzeneselenyl trifluoroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneselenyl trifluoroacetate has 0 hydrogen bond donor(s) and 2 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 Benzeneselenyl trifluoroacetate?
The CAS number of Benzeneselenyl trifluoroacetate is 51558-78-2.
What is the molecular formula of Benzeneselenyl trifluoroacetate?
The molecular formula of Benzeneselenyl trifluoroacetate is C8H5F3O2Se.
What is the molecular weight of Benzeneselenyl trifluoroacetate?
The molecular weight of Benzeneselenyl trifluoroacetate is 269.94 g/mol.
Where can I buy Benzeneselenyl trifluoroacetate?
You can request a quote for Benzeneselenyl trifluoroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneselenyl trifluoroacetate?
Yes, KEHONG BIO provides custom synthesis services for Benzeneselenyl trifluoroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.