Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate
TL;DR: Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate (CAS 57338-83-7) is a chemical compound with molecular formula C8H11NO3 and molecular weight 169.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate
Also Known As: Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate, 2-methyl-3-ethoxycarbonyl-4-hydroxypyrrole, Ethyl-1H-4-hydroxy-2-methyl-pyrrol-3-carboxylat, ETHYL-4-HYDROXY-2-METHYL-3-PYRROLECARBOXYLATE
| Molecular Formula | C8H11NO3 |
|---|---|
| Molecular Weight | 169.07 g/mol |
| LogP | 1.20542 |
| Topological Polar Surface Area | 62.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.0739 |
| Heavy Atoms | 12 |
| Complexity | 270.99313 |
Chemical Identifiers
| CAS Number | 57338-83-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC=C1O)C |
Product Overview
Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate (CAS 57338-83-7), with molecular formula C8H11NO3 and molecular weight 169.07 g/mol. IUPAC: ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate.
Chemical Property Profile of Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate
Property Insights of Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate
The XLogP value of 1.20542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate. The TPSA of 62.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate has 2 hydrogen bond donor(s) and 3 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 Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate?
The CAS number of Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate is 57338-83-7.
What is the molecular formula of Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate?
The molecular formula of Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate is C8H11NO3.
What is the molecular weight of Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate?
The molecular weight of Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate is 169.07 g/mol.
Where can I buy Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate?
You can request a quote for Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-hydroxy-2-methyl-1H-pyrrole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.