5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid
TL;DR: 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid (CAS 131172-60-6) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid
Also Known As: 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic Acid, 1H-Pyrrole-2-carboxylic acid,5-(4-ethylphenyl)-
Technical Specifications
| Molecular Formula | C13H13NO2 |
| Molecular Weight | 215.09464 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.09464 Da |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
| SMILES | CCC1=CC=C(C=C1)C2=CC=C(N2)C(=O)O |
| InChIKey | RYEWTFYYVUWZNZ-UHFFFAOYSA-N |
Chemical Property Profile of 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid
Property Insights of 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid
The XLogP value of 3.0 indicates that 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.1 Ų, 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-ethylphenyl)-1H-pyrrole-2-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 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid?
The CAS number of 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid is 131172-60-6.
What is the molecular formula of 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid?
The molecular formula of 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid is C13H13NO2.
What is the molecular weight of 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid?
The molecular weight of 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid is 215.09464 g/mol.
Where can I buy 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid?
You can request a quote for 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 5-(4-ethylphenyl)-1H-pyrrole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.