![4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid structure](/static/products/871/871366-56-2.png)
4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid
TL;DR: 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid (CAS 871366-56-2) is a chemical compound with molecular formula C16H11ClN2O2 and molecular weight 298.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-chlorophenyl)pyrazol-1-yl]benzoic acid
Also Known As: Peakdale1_001792, 4-[4-(4-CHLOROPHENYL)-1H-PYRAZOL-1-YL]BENZOIC ACID, 4-[4-(4-chlorophenyl)pyrazol-1-yl]benzoic acid, Benzoic acid, 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]-, 4-4-(4-chlorophenyl)-1H-pyrazol-1-ylbenzoic acid
| Molecular Formula | C16H11ClN2O2 |
|---|---|
| Molecular Weight | 298.05 g/mol |
| LogP | 3.8909 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.0509 |
| Heavy Atoms | 21 |
| Complexity | 776.7965 |
Chemical Identifiers
| CAS Number | 871366-56-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CN(N=C2)C3=CC=C(C=C3)C(=O)O)Cl |
Product Overview
4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid (CAS 871366-56-2), with molecular formula C16H11ClN2O2 and molecular weight 298.05 g/mol. IUPAC: 4-[4-(4-chlorophenyl)pyrazol-1-yl]benzoic acid.
Chemical Property Profile of 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid
Property Insights of 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid
The XLogP value of 3.8909 indicates that 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.12 Ų, 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic 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 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid?
The CAS number of 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid is 871366-56-2.
What is the molecular formula of 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid?
The molecular formula of 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid is C16H11ClN2O2.
What is the molecular weight of 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid?
The molecular weight of 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid is 298.05 g/mol.
Where can I buy 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid?
You can request a quote for 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(4-chlorophenyl)-1H-pyrazol-1-yl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.