![2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid structure](/static/products/1023/1023881-69-7.webp)
2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid
TL;DR: 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid (CAS 1023881-69-7) is a chemical compound with molecular formula C13H9F3N2O4 and molecular weight 314.05145 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]oxycarbonylbenzoic acid
Also Known As: 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid, 2-(((1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)oxy)carbonyl)benzoic acid, 2-({[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]oxy}carbonyl)benzoic acid, 1,2-Benzenedicarboxylic acid, 1-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl] ester
Technical Specifications
| Molecular Formula | C13H9F3N2O4 |
| Molecular Weight | 314.05145 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 81.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.05145 Da |
| Heavy Atoms | 22 |
| Complexity | 443.0 |
| SMILES | CN1C(=CC(=N1)C(F)(F)F)OC(=O)C2=CC=CC=C2C(=O)O |
| InChIKey | ZODMEPOUQABCPL-UHFFFAOYSA-N |
Chemical Property Profile of 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid
Property Insights of 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid. Following Lipinski's Rule of Five, 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid?
The CAS number of 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid is 1023881-69-7.
What is the molecular formula of 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid?
The molecular formula of 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid is C13H9F3N2O4.
What is the molecular weight of 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid?
The molecular weight of 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid is 314.05145 g/mol.
Where can I buy 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid?
You can request a quote for 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid?
Yes, CoreyChem provides custom synthesis services for 2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxycarbonylbenzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.