Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate
TL;DR: Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate (CAS 116373-89-8) is a chemical compound with molecular formula C13H13NO3 and molecular weight 231.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate
Also Known As: BAS 02841500, ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate, ethyl (2-methyl-3-indolizinyl)(oxo)acetate, ethyl (2-methylindolizin-3-yl)(oxo)acetate, (2-Methyl-indolizin-3-yl)-oxo-acetic acid ethyl ester
| Molecular Formula | C13H13NO3 |
|---|---|
| Molecular Weight | 231.09 g/mol |
| LogP | 1.99352 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.08954 |
| Heavy Atoms | 17 |
| Complexity | 583.3621 |
Chemical Identifiers
| CAS Number | 116373-89-8 |
|---|---|
| SMILES | CCOC(=O)C(=O)C1=C(C=C2N1C=CC=C2)C |
Product Overview
Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate (CAS 116373-89-8), with molecular formula C13H13NO3 and molecular weight 231.09 g/mol. IUPAC: ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate.
Chemical Property Profile of Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate
Property Insights of Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate
The XLogP value of 1.99352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate. With a topological polar surface area (TPSA) of 47.78 Ų, Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate has 0 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 2-(2-methylindolizin-3-yl)-2-oxoacetate?
The CAS number of Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate is 116373-89-8.
What is the molecular formula of Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate?
The molecular formula of Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate is C13H13NO3.
What is the molecular weight of Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate?
The molecular weight of Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate is 231.09 g/mol.
Where can I buy Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate?
You can request a quote for Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(2-methylindolizin-3-yl)-2-oxoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.