1H-Pyrazole-5-carboxylic acid
TL;DR: 1H-Pyrazole-5-carboxylic acid (CAS 23012-15-9) is a chemical compound with molecular formula C4H4N2O2 and molecular weight 112.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-pyrazole-5-carboxylic acid
Also Known As: 1H-Pyrazole-3-carboxylic acid, Pyrazole-3-carboxylic acid, 1H-Pyrazole-5-carboxylic acid, 2H-PYRAZOLE-3-CARBOXYLIC ACID, 5-Pyrazolecarboxylic acid
| Molecular Formula | C4H4N2O2 |
|---|---|
| Molecular Weight | 112.03 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 112.027275 |
| Heavy Atoms | 8 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 23012-15-9 |
|---|---|
| SMILES | C1=C(NN=C1)C(=O)O |
| InChIKey | KOPFEFZSAMLEHK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Pyrazole-5-carboxylic acid (CAS 23012-15-9), with molecular formula C4H4N2O2 and molecular weight 112.03 g/mol. IUPAC: 1H-pyrazole-5-carboxylic acid.
Chemical Property Profile of 1H-Pyrazole-5-carboxylic acid
Property Insights of 1H-Pyrazole-5-carboxylic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole-5-carboxylic acid. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrazole-5-carboxylic acid. Following Lipinski's Rule of Five, 1H-Pyrazole-5-carboxylic acid has 2 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 1H-Pyrazole-5-carboxylic acid?
The CAS number of 1H-Pyrazole-5-carboxylic acid is 23012-15-9.
What is the molecular formula of 1H-Pyrazole-5-carboxylic acid?
The molecular formula of 1H-Pyrazole-5-carboxylic acid is C4H4N2O2.
What is the molecular weight of 1H-Pyrazole-5-carboxylic acid?
The molecular weight of 1H-Pyrazole-5-carboxylic acid is 112.03 g/mol.
Where can I buy 1H-Pyrazole-5-carboxylic acid?
You can request a quote for 1H-Pyrazole-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.