4-Phenyl-1H-pyrrole-3-carboxylic acid
TL;DR: 4-Phenyl-1H-pyrrole-3-carboxylic acid (CAS 132040-12-1) is a chemical compound with molecular formula C11H9NO2 and molecular weight 187.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenyl-1H-pyrrole-3-carboxylic acid
Also Known As: 4-phenyl-1H-pyrrole-3-carboxylic Acid, 1H-Pyrrole-3-carboxylic acid, 4-phenyl-, 4-phenylpyrrole-3-carboxylic acid, 4-PHENYL-1H-PYRROLE-3-CARBOXYLICACID, 4-phenyl-1H-pyrrol-3-ylcarboxylic acid
| Molecular Formula | C11H9NO2 |
|---|---|
| Molecular Weight | 187.06 g/mol |
| LogP | 2.3799 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.06332 |
| Heavy Atoms | 14 |
| Complexity | 445.32092 |
Chemical Identifiers
| CAS Number | 132040-12-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CNC=C2C(=O)O |
Product Overview
4-Phenyl-1H-pyrrole-3-carboxylic acid (CAS 132040-12-1), with molecular formula C11H9NO2 and molecular weight 187.06 g/mol. IUPAC: 4-phenyl-1H-pyrrole-3-carboxylic acid.
Chemical Property Profile of 4-Phenyl-1H-pyrrole-3-carboxylic acid
Property Insights of 4-Phenyl-1H-pyrrole-3-carboxylic acid
The XLogP value of 2.3799 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Phenyl-1H-pyrrole-3-carboxylic acid. With a topological polar surface area (TPSA) of 53.09 Ų, 4-Phenyl-1H-pyrrole-3-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenyl-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-Phenyl-1H-pyrrole-3-carboxylic acid?
The CAS number of 4-Phenyl-1H-pyrrole-3-carboxylic acid is 132040-12-1.
What is the molecular formula of 4-Phenyl-1H-pyrrole-3-carboxylic acid?
The molecular formula of 4-Phenyl-1H-pyrrole-3-carboxylic acid is C11H9NO2.
What is the molecular weight of 4-Phenyl-1H-pyrrole-3-carboxylic acid?
The molecular weight of 4-Phenyl-1H-pyrrole-3-carboxylic acid is 187.06 g/mol.
Where can I buy 4-Phenyl-1H-pyrrole-3-carboxylic acid?
You can request a quote for 4-Phenyl-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-Phenyl-1H-pyrrole-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Phenyl-1H-pyrrole-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.