5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid
TL;DR: 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid (CAS 1038826-39-9) is a chemical compound with molecular formula C11H9ClN2O3 and molecular weight 252.03017 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-chloro-4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid
Also Known As: 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid, 3-(3-chloro-4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid, 5-(3-chloro-4-methoxy-phenyl)-2H-pyrazole-3-carboxylic Acid
Technical Specifications
| Molecular Formula | C11H9ClN2O3 |
| Molecular Weight | 252.03017 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 75.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.03017 Da |
| Heavy Atoms | 17 |
| Complexity | 290.0 |
| SMILES | COC1=C(C=C(C=C1)C2=NNC(=C2)C(=O)O)Cl |
| InChIKey | FWCMORKSBBPVPL-UHFFFAOYSA-N |
Chemical Property Profile of 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid
Property Insights of 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid. Following Lipinski's Rule of Five, 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid has 2 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 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid?
The CAS number of 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid is 1038826-39-9.
What is the molecular formula of 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid?
The molecular formula of 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid is C11H9ClN2O3.
What is the molecular weight of 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid?
The molecular weight of 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid is 252.03017 g/mol.
Where can I buy 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid?
You can request a quote for 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 5-(3-Chloro-4-methoxyphenyl)-1H-pyrazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.