![[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride structure](/static/products/922/922517-77-9.png)
[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride
TL;DR: [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride (CAS 922517-77-9) is a chemical compound with molecular formula C7H6ClF3N2O and molecular weight 226.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl chloride
Also Known As: (6-tritylsulfanylpyridin-3-yl)methanol, [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride, (5-Methyl-3-trifluoromethyl-pyrazol-1-yl)-acetyl chloride, 2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl chloride, 9-(3,5-dimethoxyphenyl)-2,7-diiodocarbazole
| Molecular Formula | C7H6ClF3N2O |
|---|---|
| Molecular Weight | 226.01 g/mol |
| LogP | 1.97572 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.01207 |
| Heavy Atoms | 14 |
| Complexity | 358.30716 |
Chemical Identifiers
| CAS Number | 922517-77-9 |
|---|---|
| SMILES | CC1=CC(=NN1CC(=O)Cl)C(F)(F)F |
Product Overview
[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride (CAS 922517-77-9), with molecular formula C7H6ClF3N2O and molecular weight 226.01 g/mol. IUPAC: 2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl chloride.
Chemical Property Profile of [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride
Property Insights of [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride
The XLogP value of 1.97572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride. With a topological polar surface area (TPSA) of 34.89 Ų, [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl 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-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride?
The CAS number of [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride is 922517-77-9.
What is the molecular formula of [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride?
The molecular formula of [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride is C7H6ClF3N2O.
What is the molecular weight of [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride?
The molecular weight of [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride is 226.01 g/mol.
Where can I buy [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride?
You can request a quote for [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride?
Yes, KEHONG BIO provides custom synthesis services for [5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.