4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole
TL;DR: 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole (CAS 244022-66-0) is a chemical compound with molecular formula C10H4ClF13N2 and molecular weight 433.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-5-methyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1H-pyrazole
Also Known As: 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole, 4-chloro-5-methyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1H-pyrazole, 4-Chloro-5(3)-methyl-3(5)-(perfluorohexyl)pyrazole, 4-Chloro-3-(tridecafluoro-1-hexyl)-5-(methyl)pyrazole, 4-chloro-3-methyl-5-(tridecafluorohexyl)-2H-pyrazole
| Molecular Formula | C10H4ClF13N2 |
|---|---|
| Molecular Weight | 433.99 g/mol |
| LogP | 5.56682 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 433.98553 |
| Heavy Atoms | 26 |
| Complexity | 674.9549 |
Chemical Identifiers
| CAS Number | 244022-66-0 |
|---|---|
| SMILES | CC1=C(C(=NN1)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cl |
Product Overview
4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole (CAS 244022-66-0), with molecular formula C10H4ClF13N2 and molecular weight 433.99 g/mol. IUPAC: 4-chloro-5-methyl-3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1H-pyrazole.
Chemical Property Profile of 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole
Property Insights of 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole
The XLogP value of 5.56682 indicates that 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.68 Ų, 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole?
The CAS number of 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole is 244022-66-0.
What is the molecular formula of 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole?
The molecular formula of 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole is C10H4ClF13N2.
What is the molecular weight of 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole?
The molecular weight of 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole is 433.99 g/mol.
Where can I buy 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole?
You can request a quote for 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-5-methyl-3-(perfluorohexyl)pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.