3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane
TL;DR: 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane (CAS 81267-93-8) is a chemical compound with molecular formula C5H6F6N2OS2 and molecular weight 287.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane
Also Known As: 3,5-bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane, 3,5-Bis[(trifluoromethyl)sulfanyl]-1,3,5-oxadiazinane
| Molecular Formula | C5H6F6N2OS2 |
|---|---|
| Molecular Weight | 287.98 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 66.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.98257 |
| Heavy Atoms | 16 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 81267-93-8 |
|---|---|
| SMILES | C1N(COCN1SC(F)(F)F)SC(F)(F)F |
| InChIKey | KVDVFVOBATVIPO-UHFFFAOYSA-N |
Product Overview
3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane (CAS 81267-93-8), with molecular formula C5H6F6N2OS2 and molecular weight 287.98 g/mol. IUPAC: 3,5-bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane.
Chemical Property Profile of 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane
Property Insights of 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane
The XLogP value of 3.5 indicates that 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane. Following Lipinski's Rule of Five, 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane has 0 hydrogen bond donor(s) and 11 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(trifluoromethylsulfanyl)-1,3,5-oxadiazinane?
The CAS number of 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane is 81267-93-8.
What is the molecular formula of 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane?
The molecular formula of 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane is C5H6F6N2OS2.
What is the molecular weight of 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane?
The molecular weight of 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane is 287.98 g/mol.
Where can I buy 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane?
You can request a quote for 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane 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(trifluoromethylsulfanyl)-1,3,5-oxadiazinane?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(trifluoromethylsulfanyl)-1,3,5-oxadiazinane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.