2-Phthalimidoethyl propionate
TL;DR: 2-Phthalimidoethyl propionate (CAS 61318-34-1) is a chemical compound with molecular formula C13H13NO4 and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)ethyl propanoate
Also Known As: 2-Phthalimidoethyl propionate, 2-phthalimidoethylpropionate, EINECS 262-708-8, 2-(1,3-dioxoisoindol-2-yl)ethyl propanoate, BAS 03079603
| Molecular Formula | C13H13NO4 |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.08446 |
| Heavy Atoms | 18 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 61318-34-1 |
|---|---|
| SMILES | CCC(=O)OCCN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | XVQDVUVUUYOALV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phthalimidoethyl propionate (CAS 61318-34-1), with molecular formula C13H13NO4 and molecular weight 247.08 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)ethyl propanoate.
Chemical Property Profile of 2-Phthalimidoethyl propionate
Property Insights of 2-Phthalimidoethyl propionate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phthalimidoethyl propionate. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Phthalimidoethyl propionate. Following Lipinski's Rule of Five, 2-Phthalimidoethyl propionate 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 2-Phthalimidoethyl propionate?
The CAS number of 2-Phthalimidoethyl propionate is 61318-34-1.
What is the molecular formula of 2-Phthalimidoethyl propionate?
The molecular formula of 2-Phthalimidoethyl propionate is C13H13NO4.
What is the molecular weight of 2-Phthalimidoethyl propionate?
The molecular weight of 2-Phthalimidoethyl propionate is 247.08 g/mol.
Where can I buy 2-Phthalimidoethyl propionate?
You can request a quote for 2-Phthalimidoethyl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phthalimidoethyl propionate?
Yes, KEHONG BIO provides custom synthesis services for 2-Phthalimidoethyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.