3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde
TL;DR: 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde (CAS 831200-04-5) is a chemical compound with molecular formula C17H15IO4 and molecular weight 410.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-5-iodo-4-phenacyloxybenzaldehyde
Also Known As: 3-ethoxy-5-iodo-4-phenacyloxybenzaldehyde, 3-ETHOXY-5-IODO-4-(2-OXO-2-PHENYLETHOXY)BENZALDEHYDE, benzaldehyde, 3-ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)-
| Molecular Formula | C17H15IO4 |
|---|---|
| Molecular Weight | 410.00 g/mol |
| LogP | 3.7641 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.0015 |
| Heavy Atoms | 22 |
| Complexity | 667.8592 |
Chemical Identifiers
| CAS Number | 831200-04-5 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C=O)I)OCC(=O)C2=CC=CC=C2 |
Product Overview
3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde (CAS 831200-04-5), with molecular formula C17H15IO4 and molecular weight 410.00 g/mol. IUPAC: 3-ethoxy-5-iodo-4-phenacyloxybenzaldehyde.
Chemical Property Profile of 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde
Property Insights of 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde
The XLogP value of 3.7641 indicates that 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde 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 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde?
The CAS number of 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde is 831200-04-5.
What is the molecular formula of 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde?
The molecular formula of 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde is C17H15IO4.
What is the molecular weight of 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde?
The molecular weight of 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde is 410.00 g/mol.
Where can I buy 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde?
You can request a quote for 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethoxy-5-iodo-4-(2-oxo-2-phenylethoxy)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.