1-Ethyl 1,2-indolizinedicarboxylate
TL;DR: 1-Ethyl 1,2-indolizinedicarboxylate (CAS 14174-97-1) is a chemical compound with molecular formula C12H11NO4 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethoxycarbonylindolizine-2-carboxylic acid
Also Known As: 1-Ethyl 1,2-indolizinedicarboxylate, 1-ethoxycarbonylindolizine-2-carboxylic Acid, 1-(ethoxycarbonyl)indolizine-2-carboxylic acid, 1,2-Indolizinedicarboxylic acid, 1-ethyl ester, AE-406/41056328
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 1.8142 |
| Topological Polar Surface Area | 68.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 585.2032 |
Chemical Identifiers
| CAS Number | 14174-97-1 |
|---|---|
| SMILES | CCOC(=O)C1=C2C=CC=CN2C=C1C(=O)O |
Product Overview
1-Ethyl 1,2-indolizinedicarboxylate (CAS 14174-97-1), with molecular formula C12H11NO4 and molecular weight 233.07 g/mol. IUPAC: 1-ethoxycarbonylindolizine-2-carboxylic acid.
Chemical Property Profile of 1-Ethyl 1,2-indolizinedicarboxylate
Property Insights of 1-Ethyl 1,2-indolizinedicarboxylate
The XLogP value of 1.8142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethyl 1,2-indolizinedicarboxylate. The TPSA of 68.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Ethyl 1,2-indolizinedicarboxylate. Following Lipinski's Rule of Five, 1-Ethyl 1,2-indolizinedicarboxylate has 1 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 1-Ethyl 1,2-indolizinedicarboxylate?
The CAS number of 1-Ethyl 1,2-indolizinedicarboxylate is 14174-97-1.
What is the molecular formula of 1-Ethyl 1,2-indolizinedicarboxylate?
The molecular formula of 1-Ethyl 1,2-indolizinedicarboxylate is C12H11NO4.
What is the molecular weight of 1-Ethyl 1,2-indolizinedicarboxylate?
The molecular weight of 1-Ethyl 1,2-indolizinedicarboxylate is 233.07 g/mol.
Where can I buy 1-Ethyl 1,2-indolizinedicarboxylate?
You can request a quote for 1-Ethyl 1,2-indolizinedicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethyl 1,2-indolizinedicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethyl 1,2-indolizinedicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.