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 187.06332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
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, 5922AA, 4-PHENYL-1H-PYRROLE-3-CARBOXYLICACID
Technical Specifications
| Molecular Formula | C11H9NO2 |
| Molecular Weight | 187.06332 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.06332 Da |
| Heavy Atoms | 14 |
| Complexity | 211.0 |
| SMILES | C1=CC=C(C=C1)C2=CNC=C2C(=O)O |
| InChIKey | IZAUZUSKFWENMY-UHFFFAOYSA-N |
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 1.9 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 53.1 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 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
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 187.06332 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 CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Phenyl-1H-pyrrole-3-carboxylic acid?
Yes, CoreyChem 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.