3-Indolineglyoxylic acid, 2-oxo-, methyl ester
TL;DR: 3-Indolineglyoxylic acid, 2-oxo-, methyl ester (CAS 22600-51-7) is a chemical compound with molecular formula C11H9NO4 and molecular weight 219.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetate
Also Known As: 3-Indolineglyoxylic acid, 2-oxo-, methyl ester, methyl 2-oxo-2-(2-oxoindolin-3-yl)acetate, 2,3-Dihydro-alpha,2-dioxo-1H-indole-3-acetic acid methyl ester, methyl 2-oxo-2-(2-oxo-2,3-dihydro-1H-indol-3-yl)acetate, methyl 2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetate
| Molecular Formula | C11H9NO4 |
|---|---|
| Molecular Weight | 219.05 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 72.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.05316 |
| Heavy Atoms | 16 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 22600-51-7 |
|---|---|
| SMILES | COC(=O)C(=O)C1C2=CC=CC=C2NC1=O |
| InChIKey | QTISFKBWRPTOBZ-UHFFFAOYSA-N |
Product Overview
3-Indolineglyoxylic acid, 2-oxo-, methyl ester (CAS 22600-51-7), with molecular formula C11H9NO4 and molecular weight 219.05 g/mol. IUPAC: methyl 2-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)acetate.
Chemical Property Profile of 3-Indolineglyoxylic acid, 2-oxo-, methyl ester
Property Insights of 3-Indolineglyoxylic acid, 2-oxo-, methyl ester
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Indolineglyoxylic acid, 2-oxo-, methyl ester. The TPSA of 72.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Indolineglyoxylic acid, 2-oxo-, methyl ester. Following Lipinski's Rule of Five, 3-Indolineglyoxylic acid, 2-oxo-, methyl ester has 1 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 3-Indolineglyoxylic acid, 2-oxo-, methyl ester?
The CAS number of 3-Indolineglyoxylic acid, 2-oxo-, methyl ester is 22600-51-7.
What is the molecular formula of 3-Indolineglyoxylic acid, 2-oxo-, methyl ester?
The molecular formula of 3-Indolineglyoxylic acid, 2-oxo-, methyl ester is C11H9NO4.
What is the molecular weight of 3-Indolineglyoxylic acid, 2-oxo-, methyl ester?
The molecular weight of 3-Indolineglyoxylic acid, 2-oxo-, methyl ester is 219.05 g/mol.
Where can I buy 3-Indolineglyoxylic acid, 2-oxo-, methyl ester?
You can request a quote for 3-Indolineglyoxylic acid, 2-oxo-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Indolineglyoxylic acid, 2-oxo-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Indolineglyoxylic acid, 2-oxo-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.