5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid
TL;DR: 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid (CAS 54367-64-5) is a chemical compound with molecular formula C10H7ClN2O2 and molecular weight 222.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-1-phenylpyrazole-4-carboxylic acid
Also Known As: 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid, 5-chloro-1-phenylpyrazole-4-carboxylic acid, IFLAB-BB F2124-0060, 5-chloro-1-phenyl-pyrazole-4-carboxylic Acid, 5-chloro-1-phenyl-1H-pyrazole-4-carboxylicacid
| Molecular Formula | C10H7ClN2O2 |
|---|---|
| Molecular Weight | 222.02 g/mol |
| LogP | 2.2239 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.0196 |
| Heavy Atoms | 15 |
| Complexity | 493.37842 |
Chemical Identifiers
| CAS Number | 54367-64-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)O)Cl |
Product Overview
5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid (CAS 54367-64-5), with molecular formula C10H7ClN2O2 and molecular weight 222.02 g/mol. IUPAC: 5-chloro-1-phenylpyrazole-4-carboxylic acid.
Chemical Property Profile of 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid
Property Insights of 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid
The XLogP value of 2.2239 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid. With a topological polar surface area (TPSA) of 55.12 Ų, 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid has 1 hydrogen bond donor(s) and 2 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-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid?
The CAS number of 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid is 54367-64-5.
What is the molecular formula of 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid?
The molecular formula of 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid is C10H7ClN2O2.
What is the molecular weight of 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid?
The molecular weight of 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid is 222.02 g/mol.
Where can I buy 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid?
You can request a quote for 5-chloro-1-phenyl-1H-pyrazole-4-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-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-1-phenyl-1H-pyrazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.