1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid
TL;DR: 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid (CAS 37560-62-6) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dimethylphenyl)pyrrole-2-carboxylic acid
Also Known As: 1-(3,5-dimethylphenyl)pyrrole-2-carboxylic acid, 1-(3,5-Dimethylphenyl)-1H-pyrrole-2-carboxylic acid
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 42.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 37560-62-6 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C=CC=C2C(=O)O)C |
| InChIKey | LRHRTPSYCSWNCG-UHFFFAOYSA-N |
Product Overview
1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid (CAS 37560-62-6), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 1-(3,5-dimethylphenyl)pyrrole-2-carboxylic acid.
Chemical Property Profile of 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid
Property Insights of 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid. With a topological polar surface area (TPSA) of 42.2 Ų, 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-Dimethylphenyl)pyrrole-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
Frequently Asked Questions
What is the CAS number of 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid?
The CAS number of 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid is 37560-62-6.
What is the molecular formula of 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid?
The molecular formula of 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid is C13H13NO2.
What is the molecular weight of 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid?
The molecular weight of 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid is 215.09 g/mol.
Where can I buy 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid?
You can request a quote for 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-Dimethylphenyl)pyrrole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.