4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione
TL;DR: 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione (CAS 168920-97-6) is a chemical compound with molecular formula C13H7F9O2 and molecular weight 366.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,5,5,6,6,7,7,7-nonafluoro-1-phenylheptane-1,3-dione
Also Known As: 4,4,5,5,6,6,7,7,7-nonafluoro-1-phenylheptane-1,3-dione, 1-Phenyl-2H,2H-perfluoroheptane-1,3-dione, 1,3-Heptanedione,4,4,5,5,6,6,7,7,7-nonafluoro-1-phenyl-, 4,4,5,5,6,6,7,7,7-nonafluoro-1-phenyl-heptane-1,3-dione, RefChem:284751
| Molecular Formula | C13H7F9O2 |
|---|---|
| Molecular Weight | 366.03 g/mol |
| LogP | 4.2967 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 366.03024 |
| Heavy Atoms | 24 |
| Complexity | 620.0796 |
Chemical Identifiers
| CAS Number | 168920-97-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CC(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
Product Overview
4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione (CAS 168920-97-6), with molecular formula C13H7F9O2 and molecular weight 366.03 g/mol. IUPAC: 4,4,5,5,6,6,7,7,7-nonafluoro-1-phenylheptane-1,3-dione.
Chemical Property Profile of 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione
Property Insights of 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione
The XLogP value of 4.2967 indicates that 4,4,5,5,6,6,7,7,7-Nonafluoro-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, 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4,5,5,6,6,7,7,7-Nonafluoro-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 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione?
The CAS number of 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione is 168920-97-6.
What is the molecular formula of 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione?
The molecular formula of 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione is C13H7F9O2.
What is the molecular weight of 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione?
The molecular weight of 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione is 366.03 g/mol.
Where can I buy 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione?
You can request a quote for 4,4,5,5,6,6,7,7,7-Nonafluoro-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 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4,4,5,5,6,6,7,7,7-Nonafluoro-1-phenylheptane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.