4-benzoyl-1H-pyrrole-2-carboxylic Acid
TL;DR: 4-benzoyl-1H-pyrrole-2-carboxylic Acid (CAS 15372-84-6) is a chemical compound with molecular formula C12H9NO3 and molecular weight 215.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-benzoyl-1H-pyrrole-2-carboxylic acid
Also Known As: 4-benzoyl-1H-pyrrole-2-carboxylic Acid, benzoylpyrrolecarboxylicacid, 4-Benzoylpyrrole-2-carboxylic acid, 4-benzoyl-pyrrole-2-carboxylic acid, 4786AD
Technical Specifications
| Molecular Formula | C12H9NO3 |
| Molecular Weight | 215.05824 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.05824 Da |
| Heavy Atoms | 16 |
| Complexity | 284.0 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CNC(=C2)C(=O)O |
| InChIKey | ZAOGOXQEINPQGB-UHFFFAOYSA-N |
Chemical Property Profile of 4-benzoyl-1H-pyrrole-2-carboxylic Acid
Property Insights of 4-benzoyl-1H-pyrrole-2-carboxylic Acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-benzoyl-1H-pyrrole-2-carboxylic Acid. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-benzoyl-1H-pyrrole-2-carboxylic Acid. Following Lipinski's Rule of Five, 4-benzoyl-1H-pyrrole-2-carboxylic Acid has 2 hydrogen bond donor(s) and 3 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-benzoyl-1H-pyrrole-2-carboxylic Acid?
The CAS number of 4-benzoyl-1H-pyrrole-2-carboxylic Acid is 15372-84-6.
What is the molecular formula of 4-benzoyl-1H-pyrrole-2-carboxylic Acid?
The molecular formula of 4-benzoyl-1H-pyrrole-2-carboxylic Acid is C12H9NO3.
What is the molecular weight of 4-benzoyl-1H-pyrrole-2-carboxylic Acid?
The molecular weight of 4-benzoyl-1H-pyrrole-2-carboxylic Acid is 215.05824 g/mol.
Where can I buy 4-benzoyl-1H-pyrrole-2-carboxylic Acid?
You can request a quote for 4-benzoyl-1H-pyrrole-2-carboxylic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-benzoyl-1H-pyrrole-2-carboxylic Acid?
Yes, CoreyChem provides custom synthesis services for 4-benzoyl-1H-pyrrole-2-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.