Ethyl phthalimidoacetate
TL;DR: Ethyl phthalimidoacetate (CAS 6974-10-3) 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.
ethyl 2-(1,3-dioxoisoindol-2-yl)acetate
Also Known As: Ethyl 2-(1,3-dioxoisoindolin-2-yl)acetate, amylsalicylate, Ethyl phthalimidoacetate, ethyl 2-(1,3-dioxoisoindol-2-yl)acetate, 2-ETHOXYCARBONYL-METHYL-PHTHALIMIDE
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 6974-10-3 |
|---|---|
| SMILES | CCOC(=O)CN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | NYNCZOLNVTXTTP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl phthalimidoacetate (CAS 6974-10-3), with molecular formula C12H11NO4 and molecular weight 233.07 g/mol. IUPAC: ethyl 2-(1,3-dioxoisoindol-2-yl)acetate.
Chemical Property Profile of Ethyl phthalimidoacetate
Property Insights of Ethyl phthalimidoacetate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl phthalimidoacetate. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl phthalimidoacetate. Following Lipinski's Rule of Five, Ethyl phthalimidoacetate has 0 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 phthalimidoacetate?
The CAS number of Ethyl phthalimidoacetate is 6974-10-3.
What is the molecular formula of Ethyl phthalimidoacetate?
The molecular formula of Ethyl phthalimidoacetate is C12H11NO4.
What is the molecular weight of Ethyl phthalimidoacetate?
The molecular weight of Ethyl phthalimidoacetate is 233.07 g/mol.
Where can I buy Ethyl phthalimidoacetate?
You can request a quote for Ethyl phthalimidoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl phthalimidoacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl phthalimidoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.