Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate
TL;DR: Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate (CAS 67520-95-0) is a chemical compound with molecular formula C12H13NO4 and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-hydroxy-2-(2-oxo-1,3-dihydroindol-3-yl)acetate
Also Known As: Ethyl 2-hydroxy-2-(2-oxoindolin-3-yl)acetate, Ethyl2-hydroxy-2-(2-oxoindolin-3-yl)acetate, Ethyl 2-hydroxy-2-(2-oxo-1,3-dihydroindol-3-yl)acetate, hydroxy-(2-oxo-indolin-3-yl)-acetic acid ethyl ester, Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate
| Molecular Formula | C12H13NO4 |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | 0.6463 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.08446 |
| Heavy Atoms | 17 |
| Complexity | 457.5738 |
Chemical Identifiers
| CAS Number | 67520-95-0 |
|---|---|
| SMILES | CCOC(=O)C(C1C2=CC=CC=C2NC1=O)O |
Product Overview
Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate (CAS 67520-95-0), with molecular formula C12H13NO4 and molecular weight 235.08 g/mol. IUPAC: ethyl 2-hydroxy-2-(2-oxo-1,3-dihydroindol-3-yl)acetate.
Chemical Property Profile of Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate
Property Insights of Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate
The XLogP value of 0.6463 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate. Following Lipinski's Rule of Five, Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate has 2 hydrogen bond donor(s) and 4 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 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate?
The CAS number of Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate is 67520-95-0.
What is the molecular formula of Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate?
The molecular formula of Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate is C12H13NO4.
What is the molecular weight of Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate?
The molecular weight of Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate is 235.08 g/mol.
Where can I buy Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate?
You can request a quote for Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,3-dihydro-alpha-hydroxy-2-oxo-3-indoleacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.