Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate
TL;DR: Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate (CAS 26502-56-7) is a chemical compound with molecular formula C12H11ClN2O3 and molecular weight 266.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(4-chlorophenyl)-4-hydroxypyrazole-3-carboxylate
Also Known As: 1-(4-Chloro-phenyl)-4-hydroxy-1H-pyrazole-3-carboxylic acid ethyl ester, IFLab1_005205, ETHYL 1-(4-CHLOROPHENYL)-4-HYDROXY-1H-PYRAZOLE-3-CARBOXYLATE, IFLAB-BB F1174-1793, ethyl 1-(4-chlorophenyl)-4-hydroxypyrazole-3-carboxylate
| Molecular Formula | C12H11ClN2O3 |
|---|---|
| Molecular Weight | 266.05 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.0458 |
| Heavy Atoms | 18 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 26502-56-7 |
|---|---|
| SMILES | CCOC(=O)C1=NN(C=C1O)C2=CC=C(C=C2)Cl |
| InChIKey | JVDIBUHUFFFVFX-UHFFFAOYSA-N |
Product Overview
Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate (CAS 26502-56-7), with molecular formula C12H11ClN2O3 and molecular weight 266.05 g/mol. IUPAC: ethyl 1-(4-chlorophenyl)-4-hydroxypyrazole-3-carboxylate.
Chemical Property Profile of Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate
Property Insights of Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate
The XLogP value of 3.3 indicates that Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate 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 Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
The CAS number of Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate is 26502-56-7.
What is the molecular formula of Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
The molecular formula of Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate is C12H11ClN2O3.
What is the molecular weight of Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
The molecular weight of Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate is 266.05 g/mol.
Where can I buy Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
You can request a quote for Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(4-chlorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.