4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione
TL;DR: 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione (CAS 63166-36-9) is a chemical compound with molecular formula C13H8F8O2 and molecular weight 348.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,5,5,6,6,7,7-octafluoro-1-phenylheptane-1,3-dione
Also Known As: TOS-BB-0352, 4,4,5,5,6,6,7,7-octafluoro-1-phenylheptane-1,3-dione, 1,3-Heptanedione, 4,4,5,5,6,6,7,7-octafluoro-1-phenyl-, RefChem:284780
| Molecular Formula | C13H8F8O2 |
|---|---|
| Molecular Weight | 348.04 g/mol |
| LogP | 3.9995 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 348.03964 |
| Heavy Atoms | 23 |
| Complexity | 582.89716 |
Chemical Identifiers
| CAS Number | 63166-36-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CC(=O)C(C(C(C(F)F)(F)F)(F)F)(F)F |
Product Overview
4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione (CAS 63166-36-9), with molecular formula C13H8F8O2 and molecular weight 348.04 g/mol. IUPAC: 4,4,5,5,6,6,7,7-octafluoro-1-phenylheptane-1,3-dione.
Chemical Property Profile of 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione
Property Insights of 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione
The XLogP value of 3.9995 indicates that 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione has 0 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 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione?
The CAS number of 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione is 63166-36-9.
What is the molecular formula of 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione?
The molecular formula of 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione is C13H8F8O2.
What is the molecular weight of 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione?
The molecular weight of 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione is 348.04 g/mol.
Where can I buy 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione?
You can request a quote for 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4,4,5,5,6,6,7,7-Octafluoro-1-phenylheptane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.