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 192.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C9H8N2O3 |
|---|---|
| Molecular Weight | 192.05 g/mol |
| LogP | 1.3783 |
| Topological Polar Surface Area | 68.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 192.0535 |
| Heavy Atoms | 14 |
| Complexity | 456.3654 |
Chemical Identifiers
| CAS Number | 108128-39-8 |
|---|---|
| SMILES | CN1C(=CC(=N1)C(=O)O)C2=CC=CO2 |
Product Overview
5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid (CAS 108128-39-8), with molecular formula C9H8N2O3 and molecular weight 192.05 g/mol. IUPAC: 5-(furan-2-yl)-1-methylpyrazole-3-carboxylic acid.
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 1.3783 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid. The TPSA of 68.26 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 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-(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 192.05 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Furan-2-yl)-1-methyl-1H-pyrazole-3-carboxylic acid?
Yes, KEHONG BIO 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.