Tetrafluoroaryl azide, tfaa
TL;DR: Tetrafluoroaryl azide, tfaa (CAS 131589-59-8) is a chemical compound with molecular formula C21H9F4N3O3S and molecular weight 459.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-azido-2,3,5,6-tetrafluorophenyl)-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone
Also Known As: Tetrafluoroaryl azide, tfaa, Tetrafluoroaryl azide,tfaa, 3-6-hydroxy-2- benzo thiophene, 3- -6-hydroxy-2- benzo thiophene, 3-(4-Azido-2,3,5,6-tetrafluorobenzoyl)-6-hydroxy-2-(4-hydroxyphenyl)benzo(b)thiophene
| Molecular Formula | C21H9F4N3O3S |
|---|---|
| Molecular Weight | 459.03 g/mol |
| LogP | 6.7087 |
| Topological Polar Surface Area | 106.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 459.03006 |
| Heavy Atoms | 32 |
| Complexity | 1432.9143 |
Chemical Identifiers
| CAS Number | 131589-59-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=C(C(=C(C(=C4F)F)N=[N+]=[N-])F)F)O |
Product Overview
Tetrafluoroaryl azide, tfaa (CAS 131589-59-8), with molecular formula C21H9F4N3O3S and molecular weight 459.03 g/mol. IUPAC: (4-azido-2,3,5,6-tetrafluorophenyl)-[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]methanone.
Chemical Property Profile of Tetrafluoroaryl azide, tfaa
Property Insights of Tetrafluoroaryl azide, tfaa
The XLogP value of 6.7087 indicates that Tetrafluoroaryl azide, tfaa is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Tetrafluoroaryl azide, tfaa. Following Lipinski's Rule of Five, Tetrafluoroaryl azide, tfaa has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetrafluoroaryl azide, tfaa?
The CAS number of Tetrafluoroaryl azide, tfaa is 131589-59-8.
What is the molecular formula of Tetrafluoroaryl azide, tfaa?
The molecular formula of Tetrafluoroaryl azide, tfaa is C21H9F4N3O3S.
What is the molecular weight of Tetrafluoroaryl azide, tfaa?
The molecular weight of Tetrafluoroaryl azide, tfaa is 459.03 g/mol.
Where can I buy Tetrafluoroaryl azide, tfaa?
You can request a quote for Tetrafluoroaryl azide, tfaa directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrafluoroaryl azide, tfaa?
Yes, KEHONG BIO provides custom synthesis services for Tetrafluoroaryl azide, tfaa and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.