1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-
TL;DR: 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- (CAS 4376-16-3) is a chemical compound with molecular formula C5F8O2 and molecular weight 243.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-difluoro-2,2-bis(trifluoromethyl)-1,3-dioxole
Also Known As: 4,5-difluoro-2,2-bis(trifluoromethyl)-1,3-dioxole, Perfluoro(2,2-Dimethyl-1,3-Dioxole), Perfluoro-2,2-Dimethyl-1,3-Dioxole, 2,2-bis(Trifluoromethyl)-4,5-difluoro-1,3-dioxole, ACN-S002451
| Molecular Formula | C5F8O2 |
|---|---|
| Molecular Weight | 243.98 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 243.97705 |
| Heavy Atoms | 15 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 4376-16-3 |
|---|---|
| SMILES | C1(=C(OC(O1)(C(F)(F)F)C(F)(F)F)F)F |
| InChIKey | YSYRISKCBOPJRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- (CAS 4376-16-3), with molecular formula C5F8O2 and molecular weight 243.98 g/mol. IUPAC: 4,5-difluoro-2,2-bis(trifluoromethyl)-1,3-dioxole.
Chemical Property Profile of 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-
Property Insights of 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-
The XLogP value of 3.0 indicates that 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- has 0 hydrogen bond donor(s) and 10 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 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-?
The CAS number of 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- is 4376-16-3.
What is the molecular formula of 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-?
The molecular formula of 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- is C5F8O2.
What is the molecular weight of 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-?
The molecular weight of 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- is 243.98 g/mol.
Where can I buy 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-?
You can request a quote for 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.