1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
TL;DR: 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid (CAS 98534-83-9) is a chemical compound with molecular formula C12H9F3N2O3 and molecular weight 286.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid
Also Known As: 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid, 1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic Acid, 4570AH, 1-(4-Methoxyphenyl)-5-(trifluoromethyl)&, 1H-Pyrazole-4-carboxylicacid, 1-(4-methoxyphenyl)-5-(trifluoromethyl)-
| Molecular Formula | C12H9F3N2O3 |
|---|---|
| Molecular Weight | 286.06 g/mol |
| LogP | 2.5979 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.05652 |
| Heavy Atoms | 20 |
| Complexity | 632.3874 |
Chemical Identifiers
| CAS Number | 98534-83-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)C(F)(F)F |
Product Overview
1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid (CAS 98534-83-9), with molecular formula C12H9F3N2O3 and molecular weight 286.06 g/mol. IUPAC: 1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxylic acid.
Chemical Property Profile of 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
Property Insights of 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
The XLogP value of 2.5979 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid. Following Lipinski's Rule of Five, 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid?
The CAS number of 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid is 98534-83-9.
What is the molecular formula of 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid?
The molecular formula of 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid is C12H9F3N2O3.
What is the molecular weight of 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid?
The molecular weight of 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid is 286.06 g/mol.
Where can I buy 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid?
You can request a quote for 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxyphenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.