1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione
TL;DR: 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione (CAS 157375-72-9) is a chemical compound with molecular formula C10H2F14O2 and molecular weight 419.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,4-trifluoro-1-(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)butane-1,3-dione
Also Known As: J2.236.843E, 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione, 1-(Perfluorocyclohexyl)-3-trifluoromethylpropan-1,3-dione, 1-(Undecafluorocyclohexyl)-4,4,4-trifluoro-1,3-butanedione, 4,4,4-trifluoro-1-(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)butane-1,3-dione
| Molecular Formula | C10H2F14O2 |
|---|---|
| Molecular Weight | 419.98 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.98312 |
| Heavy Atoms | 26 |
| Complexity | 600.0 |
Chemical Identifiers
| CAS Number | 157375-72-9 |
|---|---|
| SMILES | C(C(=O)C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)F)C(=O)C(F)(F)F |
| InChIKey | SJARYTKHGJKDEV-UHFFFAOYSA-N |
Product Overview
1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione (CAS 157375-72-9), with molecular formula C10H2F14O2 and molecular weight 419.98 g/mol. IUPAC: 4,4,4-trifluoro-1-(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)butane-1,3-dione.
Chemical Property Profile of 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione
Property Insights of 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione
The XLogP value of 4.3 indicates that 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione has 0 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione?
The CAS number of 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione is 157375-72-9.
What is the molecular formula of 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione?
The molecular formula of 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione is C10H2F14O2.
What is the molecular weight of 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione?
The molecular weight of 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione is 419.98 g/mol.
Where can I buy 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione?
You can request a quote for 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-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 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-Undecafluorocyclohexyl-3-trifluoromethylpropan-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.