1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol
TL;DR: 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol (CAS 54841-08-6) is a chemical compound with molecular formula C8H6F12O2 and molecular weight 362.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,6,6,6-hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol
Also Known As: 1,1,1,6,6,6-hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol, 1,1,4,4-tetrakis(trifluoromethyl) butan-1,4-diol, 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)-2,5-hexanediol, 1,1,1,6,6,6-hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-di, 2,5-Hexanediol, 1,1,1,6,6,6-hexafluoro-2,5-bis(trifluoromethyl)-
| Molecular Formula | C8H6F12O2 |
|---|---|
| Molecular Weight | 362.02 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.0176 |
| Heavy Atoms | 22 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 54841-08-6 |
|---|---|
| SMILES | C(CC(C(F)(F)F)(C(F)(F)F)O)C(C(F)(F)F)(C(F)(F)F)O |
| InChIKey | WXKKSHCCJRPPMA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol (CAS 54841-08-6), with molecular formula C8H6F12O2 and molecular weight 362.02 g/mol. IUPAC: 1,1,1,6,6,6-hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol.
Chemical Property Profile of 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol
Property Insights of 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol
The XLogP value of 3.8 indicates that 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol?
The CAS number of 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol is 54841-08-6.
What is the molecular formula of 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol?
The molecular formula of 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol is C8H6F12O2.
What is the molecular weight of 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol?
The molecular weight of 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol is 362.02 g/mol.
Where can I buy 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol?
You can request a quote for 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,6,6,6-Hexafluoro-2,5-bis(trifluoromethyl)hexane-2,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.