3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole
TL;DR: 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole (CAS 4314-46-9) is a chemical compound with molecular formula C8F14N2O and molecular weight 405.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-bis(1,1,2,2,3,3,3-heptafluoropropyl)-1,2,4-oxadiazole
Also Known As: 3,5-bis(heptafluoropropyl)-1,2,4-oxadiazole, 3,5-bis(1,1,2,2,3,3,3-heptafluoropropyl)-1,2,4-oxadiazole, 1,2,4-Oxadiazole,3,5-bis(1,1,2,2,3,3,3-heptafluoropropyl)-, 3,5-Bis-<1,1,2,2,3,3,3-heptafluor-propyl>-1,2,4-oxadiazol
| Molecular Formula | C8F14N2O |
|---|---|
| Molecular Weight | 405.98 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 38.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.9787 |
| Heavy Atoms | 25 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 4314-46-9 |
|---|---|
| SMILES | C1(=NOC(=N1)C(C(C(F)(F)F)(F)F)(F)F)C(C(C(F)(F)F)(F)F)(F)F |
| InChIKey | QLZJEMNNZRGUSV-UHFFFAOYSA-N |
Product Overview
3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole (CAS 4314-46-9), with molecular formula C8F14N2O and molecular weight 405.98 g/mol. IUPAC: 3,5-bis(1,1,2,2,3,3,3-heptafluoropropyl)-1,2,4-oxadiazole.
Chemical Property Profile of 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole
Property Insights of 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole
The XLogP value of 4.7 indicates that 3,5-Bis(heptafluoropropyl)-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 38.9 Ų, 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole has 0 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole?
The CAS number of 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole is 4314-46-9.
What is the molecular formula of 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole?
The molecular formula of 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole is C8F14N2O.
What is the molecular weight of 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole?
The molecular weight of 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole is 405.98 g/mol.
Where can I buy 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole?
You can request a quote for 3,5-Bis(heptafluoropropyl)-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 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(heptafluoropropyl)-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.