1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane
TL;DR: 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane (CAS 382-26-3) is a chemical compound with molecular formula C5H4F8O and molecular weight 232.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[difluoro(methoxy)methyl]-1,1,1,3,3,3-hexafluoropropane
Also Known As: Octafluoroisobutyl methyl ether, (CF3)2CHCF2OCH3, 3-Ethyl-2-methyl-1-pentene, 2-[difluoro(methoxy)methyl]-1,1,1,3,3,3-hexafluoropropane, ETHER, METHYL OCTAFLUOROISOBUTYL
| Molecular Formula | C5H4F8O |
|---|---|
| Molecular Weight | 232.01 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.01344 |
| Heavy Atoms | 14 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 382-26-3 |
|---|---|
| SMILES | COC(C(C(F)(F)F)C(F)(F)F)(F)F |
| InChIKey | AQHKYFLVHBIQMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane (CAS 382-26-3), with molecular formula C5H4F8O and molecular weight 232.01 g/mol. IUPAC: 2-[difluoro(methoxy)methyl]-1,1,1,3,3,3-hexafluoropropane.
Chemical Property Profile of 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane
Property Insights of 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane
The XLogP value of 3.3 indicates that 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane has 0 hydrogen bond donor(s) and 9 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 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane?
The CAS number of 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane is 382-26-3.
What is the molecular formula of 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane?
The molecular formula of 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane is C5H4F8O.
What is the molecular weight of 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane?
The molecular weight of 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane is 232.01 g/mol.
Where can I buy 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane?
You can request a quote for 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,3,3-Pentafluoro-3-methoxy-2-(trifluoromethyl)propane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.