5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid
TL;DR: 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid (CAS 108128-39-8) is a chemical compound with molecular formula C9H8N2O3 and molecular weight 192.0535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(furan-2-yl)-1-methylpyrazole-3-carboxylic acid
Also Known As: 5-(2-Furyl)-1-methyl-1H-pyrazole-3-carboxylic acid, 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid, 1-Benzenesulfonyl-1H-pyrazole, 5-(furan-2-yl)-1-methylpyrazole-3-carboxylic acid, 5-(2-furyl)-1-methyl-pyrazole-3-carboxylic Acid
Technical Specifications
| Molecular Formula | C9H8N2O3 |
| Molecular Weight | 192.0535 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.0535 Da |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
| SMILES | CN1C(=CC(=N1)C(=O)O)C2=CC=CO2 |
| InChIKey | XXEWHNSDJMBLBK-UHFFFAOYSA-N |
Chemical Property Profile of 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid
Property Insights of 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid. Following Lipinski's Rule of Five, 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid has 1 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-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid?
The CAS number of 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid is 108128-39-8.
What is the molecular formula of 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid?
The molecular formula of 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid is C9H8N2O3.
What is the molecular weight of 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid?
The molecular weight of 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid is 192.0535 g/mol.
Where can I buy 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid?
You can request a quote for 5-(Furan-2-yl)-1-methyl-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-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.