4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid
TL;DR: 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid (CAS 122453-98-9) is a chemical compound with molecular formula C11H8ClNO2 and molecular weight 221.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic acid
Also Known As: 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid, 4-(4-CHLORO-PHENYL)-1H-PYRROLE-3-CARBOXYLIC ACID, 2521AD, 1H-Pyrrole-3-carboxylic acid, 4-(4-chlorophenyl)-, 1H-Pyrrole-3-carboxylicacid, 4-(4-chlorophenyl)-
| Molecular Formula | C11H8ClNO2 |
|---|---|
| Molecular Weight | 221.02 g/mol |
| LogP | 3.0333 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.02435 |
| Heavy Atoms | 15 |
| Complexity | 487.54395 |
Chemical Identifiers
| CAS Number | 122453-98-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CNC=C2C(=O)O)Cl |
Product Overview
4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid (CAS 122453-98-9), with molecular formula C11H8ClNO2 and molecular weight 221.02 g/mol. IUPAC: 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic acid.
Chemical Property Profile of 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid
Property Insights of 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid
The XLogP value of 3.0333 indicates that 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid has 2 hydrogen bond donor(s) and 1 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-chlorophenyl)-1H-pyrrole-3-carboxylic Acid?
The CAS number of 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid is 122453-98-9.
What is the molecular formula of 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid?
The molecular formula of 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid is C11H8ClNO2.
What is the molecular weight of 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid?
The molecular weight of 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid is 221.02 g/mol.
Where can I buy 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid?
You can request a quote for 4-(4-chlorophenyl)-1H-pyrrole-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 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-chlorophenyl)-1H-pyrrole-3-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.