2-(2-formyl-1H-pyrrol-1-yl)benzoic acid
TL;DR: 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid (CAS 55540-44-8) is a chemical compound with molecular formula C12H9NO3 and molecular weight 215.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-formylpyrrol-1-yl)benzoic acid
Also Known As: 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid, 2-(2-formylpyrrol-1-yl)benzoic Acid, 2-(2-Formyl-pyrrol-1-yl)-benzoic acid, 2-(2-Formyl-1-pyrrolyl)benzoic Acid, 2-(2-formyl-1H-pyrrol-1-yl)benzoicacid
| Molecular Formula | C12H9NO3 |
|---|---|
| Molecular Weight | 215.06 g/mol |
| LogP | 1.988 |
| Topological Polar Surface Area | 59.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.05824 |
| Heavy Atoms | 16 |
| Complexity | 542.70184 |
Chemical Identifiers
| CAS Number | 55540-44-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)N2C=CC=C2C=O |
Product Overview
2-(2-formyl-1H-pyrrol-1-yl)benzoic acid (CAS 55540-44-8), with molecular formula C12H9NO3 and molecular weight 215.06 g/mol. IUPAC: 2-(2-formylpyrrol-1-yl)benzoic acid.
Chemical Property Profile of 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid
Property Insights of 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid
The XLogP value of 1.988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid. With a topological polar surface area (TPSA) of 59.3 Ų, 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-formyl-1H-pyrrol-1-yl)benzoic 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
Frequently Asked Questions
What is the CAS number of 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid?
The CAS number of 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid is 55540-44-8.
What is the molecular formula of 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid?
The molecular formula of 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid is C12H9NO3.
What is the molecular weight of 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid?
The molecular weight of 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid is 215.06 g/mol.
Where can I buy 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid?
You can request a quote for 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-formyl-1H-pyrrol-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.