5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride
TL;DR: 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride (CAS 128564-57-8) is a chemical compound with molecular formula C6H3Cl2F3N2O and molecular weight 245.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl chloride
Also Known As: BUTTPARK, Buttpark99\18-37, 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride, BUTTPARK 99\18-37, 5-chloro-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl chloride
| Molecular Formula | C6H3Cl2F3N2O |
|---|---|
| Molecular Weight | 245.96 g/mol |
| LogP | 2.4713 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.95746 |
| Heavy Atoms | 14 |
| Complexity | 385.16373 |
Chemical Identifiers
| CAS Number | 128564-57-8 |
|---|---|
| SMILES | CN1C(=C(C(=N1)C(F)(F)F)C(=O)Cl)Cl |
Product Overview
5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride (CAS 128564-57-8), with molecular formula C6H3Cl2F3N2O and molecular weight 245.96 g/mol. IUPAC: 5-chloro-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonyl chloride.
Chemical Property Profile of 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride
Property Insights of 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride
The XLogP value of 2.4713 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride. With a topological polar surface area (TPSA) of 34.89 Ų, 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride 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 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride?
The CAS number of 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride is 128564-57-8.
What is the molecular formula of 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride?
The molecular formula of 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride is C6H3Cl2F3N2O.
What is the molecular weight of 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride?
The molecular weight of 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride is 245.96 g/mol.
Where can I buy 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride?
You can request a quote for 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carbonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.