1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester
TL;DR: 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester (CAS 199480-36-9) is a chemical compound with molecular formula C8H9N2O4- and molecular weight 197.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxycarbonyl-1-methylpyrazole-5-carboxylate
Also Known As: Telmisartan methyl ester, 5-ethoxycarbonyl-2-methylpyrazole-3-carboxylate, 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester, 3-(ethoxycarbonyl)-1-methyl-1H-pyrazole-5-carboxylic acid
| Molecular Formula | C8H9N2O4- |
|---|---|
| Molecular Weight | 197.06 g/mol |
| LogP | -1.0397 |
| Topological Polar Surface Area | 84.25 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.05623 |
| Heavy Atoms | 14 |
| Complexity | 369.4182 |
Chemical Identifiers
| CAS Number | 199480-36-9 |
|---|---|
| SMILES | CCOC(=O)C1=NN(C(=C1)C(=O)[O-])C |
Product Overview
1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester (CAS 199480-36-9), with molecular formula C8H9N2O4- and molecular weight 197.06 g/mol. IUPAC: 3-ethoxycarbonyl-1-methylpyrazole-5-carboxylate.
Chemical Property Profile of 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester
Property Insights of 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester
The XLogP value of -1.0397 indicates that 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester. Following Lipinski's Rule of Five, 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester has 0 hydrogen bond donor(s) and 5 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 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester?
The CAS number of 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester is 199480-36-9.
What is the molecular formula of 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester?
The molecular formula of 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester is C8H9N2O4-.
What is the molecular weight of 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester?
The molecular weight of 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester is 197.06 g/mol.
Where can I buy 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester?
You can request a quote for 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole-3,5-dicarboxylic acid, 1-methyl-, 3-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.