1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol
TL;DR: 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol (CAS 247170-26-9) is a chemical compound with molecular formula C18H12F6O2 and molecular weight 374.07 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-diphenylhex-3-yne-2,5-diol
Also Known As: 1,4-Bis(trifluoromethyl)-1,4-diphenyl-2-butyn-1,4-diol, 1,1,1,6,6,6-hexafluoro-2,5-diphenylhex-3-yne-2,5-diol, 1,4-Bis(trifluoromethyl)-1,4-diphenyl-2, 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yn-2,5-diol, I14-46822
| Molecular Formula | C18H12F6O2 |
|---|---|
| Molecular Weight | 374.07 g/mol |
| LogP | 3.89 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 374.07416 |
| Heavy Atoms | 26 |
| Complexity | 737.3055 |
Chemical Identifiers
| CAS Number | 247170-26-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C#CC(C2=CC=CC=C2)(C(F)(F)F)O)(C(F)(F)F)O |
Product Overview
1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol (CAS 247170-26-9), with molecular formula C18H12F6O2 and molecular weight 374.07 g/mol. IUPAC: 1,1,1,6,6,6-hexafluoro-2,5-diphenylhex-3-yne-2,5-diol.
Chemical Property Profile of 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol
Property Insights of 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol
The XLogP value of 3.89 indicates that 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-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-diphenylhex-3-yne-2,5-diol has 2 hydrogen bond donor(s) and 2 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 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol?
The CAS number of 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol is 247170-26-9.
What is the molecular formula of 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol?
The molecular formula of 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol is C18H12F6O2.
What is the molecular weight of 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol?
The molecular weight of 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol is 374.07 g/mol.
Where can I buy 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol?
You can request a quote for 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-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-diphenylhex-3-yne-2,5-diol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,6,6,6-Hexafluoro-2,5-diphenylhex-3-yne-2,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.