1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione
TL;DR: 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione (CAS 20825-07-4) is a chemical compound with molecular formula C6H2F8O2 and molecular weight 257.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,5,5,6,6,6-octafluorohexane-2,4-dione
Also Known As: 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione, 1,1,1,5,5,6,6,6-octafluorohexane-2,4-dione, 3H,3H-Octafluorohexane-2,4-dione, 3H,3H-Perfluoro-2,4-hexanedione, 3H,3H-Perfluorohexane-2,4-dione
| Molecular Formula | C6H2F8O2 |
|---|---|
| Molecular Weight | 257.99 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.9927 |
| Heavy Atoms | 16 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 20825-07-4 |
|---|---|
| SMILES | C(C(=O)C(C(F)(F)F)(F)F)C(=O)C(F)(F)F |
| InChIKey | MGKBKOFWQWACLM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione (CAS 20825-07-4), with molecular formula C6H2F8O2 and molecular weight 257.99 g/mol. IUPAC: 1,1,1,5,5,6,6,6-octafluorohexane-2,4-dione.
Chemical Property Profile of 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione
Property Insights of 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione. With a topological polar surface area (TPSA) of 34.1 Ų, 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione 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 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione?
The CAS number of 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione is 20825-07-4.
What is the molecular formula of 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione?
The molecular formula of 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione is C6H2F8O2.
What is the molecular weight of 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione?
The molecular weight of 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione is 257.99 g/mol.
Where can I buy 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione?
You can request a quote for 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,5,5,6,6,6-Octafluoro-2,4-hexanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.