![5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid structure](/static/products/3123/312309-03-8.webp)
5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid
TL;DR: 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid (CAS 312309-03-8) is a chemical compound with molecular formula C9H7ClN2O3 and molecular weight 226.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-chloropyrazol-1-yl)methyl]furan-2-carboxylic acid
Also Known As: 5-[(4-Chloro-1H-pyrazol-1-yl)methyl]-2-furoic acid, 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid, 5-(4-Chloro-pyrazol-1-ylmethyl)-furan-2-carboxylic acid, 5-[(4-chloropyrazol-1-yl)methyl]furan-2-carboxylic acid, 5-((4-Chloro-1H-pyrazol-1-yl)methyl)furan-2-carboxylic acid
| Molecular Formula | C9H7ClN2O3 |
|---|---|
| Molecular Weight | 226.01 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.01453 |
| Heavy Atoms | 15 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 312309-03-8 |
|---|---|
| SMILES | C1=C(OC(=C1)C(=O)O)CN2C=C(C=N2)Cl |
| InChIKey | FTDBLLSABPDLMJ-UHFFFAOYSA-N |
Product Overview
5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid (CAS 312309-03-8), with molecular formula C9H7ClN2O3 and molecular weight 226.01 g/mol. IUPAC: 5-[(4-chloropyrazol-1-yl)methyl]furan-2-carboxylic acid.
Chemical Property Profile of 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid
Property Insights of 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid. Following Lipinski's Rule of Five, 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-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
Frequently Asked Questions
What is the CAS number of 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid?
The CAS number of 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid is 312309-03-8.
What is the molecular formula of 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid?
The molecular formula of 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid is C9H7ClN2O3.
What is the molecular weight of 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid?
The molecular weight of 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid is 226.01 g/mol.
Where can I buy 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid?
You can request a quote for 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-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-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-chloro-1H-pyrazol-1-yl)methyl]furan-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.