2-methyl-1H-pyrrole-3,4-dicarboxylic Acid
TL;DR: 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid (CAS 89937-81-5) is a chemical compound with molecular formula C7H7NO4 and molecular weight 169.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1H-pyrrole-3,4-dicarboxylic acid
Also Known As: 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid, PYRROLIDINE, 2-Methyl-pyrrol-3,4-dicarbonsaeure, 1H-Pyrrole-3,4-dicarboxylicacid, 2-methyl-, 1H-Pyrrole-3,4-dicarboxylic acid, 2-methyl-
| Molecular Formula | C7H7NO4 |
|---|---|
| Molecular Weight | 169.04 g/mol |
| LogP | 0.71952 |
| Topological Polar Surface Area | 90.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.0375 |
| Heavy Atoms | 12 |
| Complexity | 339.17563 |
Chemical Identifiers
| CAS Number | 89937-81-5 |
|---|---|
| SMILES | CC1=C(C(=CN1)C(=O)O)C(=O)O |
Product Overview
2-methyl-1H-pyrrole-3,4-dicarboxylic Acid (CAS 89937-81-5), with molecular formula C7H7NO4 and molecular weight 169.04 g/mol. IUPAC: 2-methyl-1H-pyrrole-3,4-dicarboxylic acid.
Chemical Property Profile of 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid
Property Insights of 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid
The XLogP value of 0.71952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid. The TPSA of 90.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid. Following Lipinski's Rule of Five, 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid has 3 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-methyl-1H-pyrrole-3,4-dicarboxylic Acid?
The CAS number of 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid is 89937-81-5.
What is the molecular formula of 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid?
The molecular formula of 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid is C7H7NO4.
What is the molecular weight of 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid?
The molecular weight of 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid is 169.04 g/mol.
Where can I buy 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid?
You can request a quote for 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-1H-pyrrole-3,4-dicarboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.