5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid
TL;DR: 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid (CAS 89417-94-7) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-1-methylpyrazole-5-carboxylic acid
Also Known As: 5-(4-methoxyphenyl)-2-methylpyrazole-3-carboxylic acid, 3-(4-methoxyphenyl)-1-methyl-1H-pyrazole-5-carboxylic acid, BB_SC-6166, ASN 14036286, 5-(4-Methoxy-phenyl)-2-methyl-2H-pyrazole-3-carboxylic acid
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 1.7939 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 543.3784 |
Chemical Identifiers
| CAS Number | 89417-94-7 |
|---|---|
| SMILES | CN1C(=CC(=N1)C2=CC=C(C=C2)OC)C(=O)O |
Product Overview
5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid (CAS 89417-94-7), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: 3-(4-methoxyphenyl)-1-methylpyrazole-5-carboxylic acid.
Chemical Property Profile of 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid
Property Insights of 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid
The XLogP value of 1.7939 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid. Following Lipinski's Rule of Five, 5-(4-Methoxyphenyl)-2-methylpyrazole-3-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 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid?
The CAS number of 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid is 89417-94-7.
What is the molecular formula of 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid?
The molecular formula of 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid is C12H12N2O3.
What is the molecular weight of 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid?
The molecular weight of 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid is 232.08 g/mol.
Where can I buy 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid?
You can request a quote for 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Methoxyphenyl)-2-methylpyrazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.