2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid
TL;DR: 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid (CAS 166096-35-1) is a chemical compound with molecular formula C12H11NO5 and molecular weight 249.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methoxyethyl)-1,3-dioxoisoindole-5-carboxylic acid
Also Known As: 2-(2-methoxyethyl)-1,3-dioxoisoindoline-5-carboxylic acid, 2-(2-methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid, 2-(2-methoxyethyl)-1,3-dioxoisoindole-5-carboxylic acid, 2-(2-methoxyethyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid, 2-(2-METHOXY-ETHYL)-1,3-DIOXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID
| Molecular Formula | C12H11NO5 |
|---|---|
| Molecular Weight | 249.06 g/mol |
| LogP | 0.6272 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.06372 |
| Heavy Atoms | 18 |
| Complexity | 537.26935 |
Chemical Identifiers
| CAS Number | 166096-35-1 |
|---|---|
| SMILES | COCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)O |
Product Overview
2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid (CAS 166096-35-1), with molecular formula C12H11NO5 and molecular weight 249.06 g/mol. IUPAC: 2-(2-methoxyethyl)-1,3-dioxoisoindole-5-carboxylic acid.
Chemical Property Profile of 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid
Property Insights of 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid
The XLogP value of 0.6272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid. Following Lipinski's Rule of Five, 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid 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 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid?
The CAS number of 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid is 166096-35-1.
What is the molecular formula of 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid?
The molecular formula of 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid is C12H11NO5.
What is the molecular weight of 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid?
The molecular weight of 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid is 249.06 g/mol.
Where can I buy 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid?
You can request a quote for 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methoxyethyl)-1,3-dioxo-5-isoindolinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.