1-Methyl-3-(trifluoromethyl)-1H-pyrazole
TL;DR: 1-Methyl-3-(trifluoromethyl)-1H-pyrazole (CAS 154471-65-5) is a chemical compound with molecular formula C5H5F3N2 and molecular weight 150.04048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-3-(trifluoromethyl)pyrazole
Also Known As: 1-Methyl-3-(trifluoromethyl)-1H-pyrazole, 1-methyl-3-(trifluoromethyl)pyrazole, 1-Methyl-3-trifluoromethyl-1H-pyrazole, 1-methyl-3-trifluoromethylpyrazol, 1-Methyl-3-trifluoromethylpyrazole
Technical Specifications
| Molecular Formula | C5H5F3N2 |
| Molecular Weight | 150.04048 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 17.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 150.04048 Da |
| Heavy Atoms | 10 |
| Complexity | 123.0 |
| SMILES | CN1C=CC(=N1)C(F)(F)F |
| InChIKey | MQSLINQSJFALSP-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methyl-3-(trifluoromethyl)-1H-pyrazole
Property Insights of 1-Methyl-3-(trifluoromethyl)-1H-pyrazole
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-(trifluoromethyl)-1H-pyrazole. With a topological polar surface area (TPSA) of 17.8 Ų, 1-Methyl-3-(trifluoromethyl)-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-(trifluoromethyl)-1H-pyrazole has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methyl-3-(trifluoromethyl)-1H-pyrazole?
The CAS number of 1-Methyl-3-(trifluoromethyl)-1H-pyrazole is 154471-65-5.
What is the molecular formula of 1-Methyl-3-(trifluoromethyl)-1H-pyrazole?
The molecular formula of 1-Methyl-3-(trifluoromethyl)-1H-pyrazole is C5H5F3N2.
What is the molecular weight of 1-Methyl-3-(trifluoromethyl)-1H-pyrazole?
The molecular weight of 1-Methyl-3-(trifluoromethyl)-1H-pyrazole is 150.04048 g/mol.
Where can I buy 1-Methyl-3-(trifluoromethyl)-1H-pyrazole?
You can request a quote for 1-Methyl-3-(trifluoromethyl)-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methyl-3-(trifluoromethyl)-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 1-Methyl-3-(trifluoromethyl)-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.