5-Phenyl-1-vinylpyrrole-2-carboxylic acid
TL;DR: 5-Phenyl-1-vinylpyrrole-2-carboxylic acid (CAS 131172-65-1) is a chemical compound with molecular formula C13H11NO2 and molecular weight 213.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-ethenyl-5-phenylpyrrole-2-carboxylic acid
Also Known As: BAS 01154071, 1-ethenyl-5-phenyl-1h-pyrrole-2-carboxylic acid, 5-phenyl-1-vinylpyrrole-2-carboxylic acid, 1-ethenyl-5-phenylpyrrole-2-carboxylic acid, 1-Vinyl-5-phenyl-1H-pyrrole-2-carboxylic acid
Technical Specifications
| Molecular Formula | C13H11NO2 |
| Molecular Weight | 213.07898 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 42.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.07898 Da |
| Heavy Atoms | 16 |
| Complexity | 271.0 |
| SMILES | C=CN1C(=CC=C1C(=O)O)C2=CC=CC=C2 |
| InChIKey | PVDKQFBRJFNBLM-UHFFFAOYSA-N |
Chemical Property Profile of 5-Phenyl-1-vinylpyrrole-2-carboxylic acid
Property Insights of 5-Phenyl-1-vinylpyrrole-2-carboxylic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenyl-1-vinylpyrrole-2-carboxylic acid. With a topological polar surface area (TPSA) of 42.2 Ų, 5-Phenyl-1-vinylpyrrole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Phenyl-1-vinylpyrrole-2-carboxylic acid has 1 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-Phenyl-1-vinylpyrrole-2-carboxylic acid?
The CAS number of 5-Phenyl-1-vinylpyrrole-2-carboxylic acid is 131172-65-1.
What is the molecular formula of 5-Phenyl-1-vinylpyrrole-2-carboxylic acid?
The molecular formula of 5-Phenyl-1-vinylpyrrole-2-carboxylic acid is C13H11NO2.
What is the molecular weight of 5-Phenyl-1-vinylpyrrole-2-carboxylic acid?
The molecular weight of 5-Phenyl-1-vinylpyrrole-2-carboxylic acid is 213.07898 g/mol.
Where can I buy 5-Phenyl-1-vinylpyrrole-2-carboxylic acid?
You can request a quote for 5-Phenyl-1-vinylpyrrole-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Phenyl-1-vinylpyrrole-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 5-Phenyl-1-vinylpyrrole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.