2-Ethoxy-4-formyl-6-iodophenyl propionate
TL;DR: 2-Ethoxy-4-formyl-6-iodophenyl propionate (CAS 831230-59-2) is a chemical compound with molecular formula C12H13IO4 and molecular weight 347.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethoxy-4-formyl-6-iodophenyl) propanoate
Also Known As: 2-ethoxy-4-formyl-6-iodophenyl propionate, (2-ethoxy-4-formyl-6-iodophenyl) propanoate, 2-ETHOXY-4-FORMYL-6-IODOPHENYL PROPANOATE
| Molecular Formula | C12H13IO4 |
|---|---|
| Molecular Weight | 347.99 g/mol |
| LogP | 2.8178 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.98587 |
| Heavy Atoms | 17 |
| Complexity | 428.75897 |
Chemical Identifiers
| CAS Number | 831230-59-2 |
|---|---|
| SMILES | CCC(=O)OC1=C(C=C(C=C1I)C=O)OCC |
Product Overview
2-Ethoxy-4-formyl-6-iodophenyl propionate (CAS 831230-59-2), with molecular formula C12H13IO4 and molecular weight 347.99 g/mol. IUPAC: (2-ethoxy-4-formyl-6-iodophenyl) propanoate.
Chemical Property Profile of 2-Ethoxy-4-formyl-6-iodophenyl propionate
Property Insights of 2-Ethoxy-4-formyl-6-iodophenyl propionate
The XLogP value of 2.8178 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethoxy-4-formyl-6-iodophenyl propionate. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Ethoxy-4-formyl-6-iodophenyl propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethoxy-4-formyl-6-iodophenyl 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-Ethoxy-4-formyl-6-iodophenyl propionate?
The CAS number of 2-Ethoxy-4-formyl-6-iodophenyl propionate is 831230-59-2.
What is the molecular formula of 2-Ethoxy-4-formyl-6-iodophenyl propionate?
The molecular formula of 2-Ethoxy-4-formyl-6-iodophenyl propionate is C12H13IO4.
What is the molecular weight of 2-Ethoxy-4-formyl-6-iodophenyl propionate?
The molecular weight of 2-Ethoxy-4-formyl-6-iodophenyl propionate is 347.99 g/mol.
Where can I buy 2-Ethoxy-4-formyl-6-iodophenyl propionate?
You can request a quote for 2-Ethoxy-4-formyl-6-iodophenyl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethoxy-4-formyl-6-iodophenyl propionate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethoxy-4-formyl-6-iodophenyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.