![1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone structure](/static/products/959/959583-92-7.png)
1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone
TL;DR: 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone (CAS 959583-92-7) is a chemical compound with molecular formula C15H9F9N2O and molecular weight 404.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone
Also Known As: 1-Acetyl-3(5)-nonafluorobutyl-5(3)-phenylpyrazole, 1-Acetyl-3-nonafluorobutyl-5-phenylpyrazole, 1-Acetyl-3(5)-(perfluorobutyl)-5(3)-phenylpyrazole, 1-[3-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone, 1-ACETYL-3(5)-PERFLUOROBUTYL-5(3)-PHENYLPYRAZOLE
| Molecular Formula | C15H9F9N2O |
|---|---|
| Molecular Weight | 404.06 g/mol |
| LogP | 5.1349 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.05713 |
| Heavy Atoms | 27 |
| Complexity | 840.71765 |
Chemical Identifiers
| CAS Number | 959583-92-7 |
|---|---|
| SMILES | CC(=O)N1C(=CC(=N1)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C2=CC=CC=C2 |
Product Overview
1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone (CAS 959583-92-7), with molecular formula C15H9F9N2O and molecular weight 404.06 g/mol. IUPAC: 1-[3-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone.
Chemical Property Profile of 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone
Property Insights of 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone
The XLogP value of 5.1349 indicates that 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone?
The CAS number of 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone is 959583-92-7.
What is the molecular formula of 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone?
The molecular formula of 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone is C15H9F9N2O.
What is the molecular weight of 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone?
The molecular weight of 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone is 404.06 g/mol.
Where can I buy 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone?
You can request a quote for 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)-5-phenylpyrazol-1-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.