3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole
TL;DR: 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole (CAS 146304-76-9) is a chemical compound with molecular formula C14H5F13N2O and molecular weight 464.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1,2,4-oxadiazole
Also Known As: 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole, 3-phenyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1,2,4-oxadiazole, RefChem:281763
| Molecular Formula | C14H5F13N2O |
|---|---|
| Molecular Weight | 464.02 g/mol |
| LogP | 5.9319 |
| Topological Polar Surface Area | 38.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.01944 |
| Heavy Atoms | 30 |
| Complexity | 888.74133 |
Chemical Identifiers
| CAS Number | 146304-76-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NOC(=N2)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
Product Overview
3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole (CAS 146304-76-9), with molecular formula C14H5F13N2O and molecular weight 464.02 g/mol. IUPAC: 3-phenyl-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1,2,4-oxadiazole.
Chemical Property Profile of 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole
Property Insights of 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole
The XLogP value of 5.9319 indicates that 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.92 Ų, 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole?
The CAS number of 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole is 146304-76-9.
What is the molecular formula of 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole?
The molecular formula of 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole is C14H5F13N2O.
What is the molecular weight of 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole?
The molecular weight of 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole is 464.02 g/mol.
Where can I buy 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole?
You can request a quote for 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-5-(tridecafluorohexyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.