TL;DR: 4-[2-[2-(4-Formylphenoxy)ethoxy]ethoxy]benzaldehyde (CAS 111550-46-0) is a chemical compound with molecular formula C18H18O5 and molecular weight 314.11542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-[2-(4-formylphenoxy)ethoxy]ethoxy]benzaldehyde
Also Known As: 7-bromopyrido[3,2-b]pyrazine, 4-[2-[2-(4-formylphenoxy)ethoxy]ethoxy]benzaldehyde, Phosphorin,1,2,3,6-tetrahydro, Benzaldehyde,4,4'-[oxybis(2,1-ethanediyloxy)]bis-, 4,4'-(3-OXAPENTANEDIYLDIOXY)DIBENZALDEHYDE
| Molecular Formula | C18H18O5 |
| Molecular Weight | 314.11542 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 314.11542 Da |
| Heavy Atoms | 23 |
| Complexity | 298.0 |
| SMILES | C1=CC(=CC=C1C=O)OCCOCCOC2=CC=C(C=C2)C=O |
| InChIKey | JAIPDYDZPPCMBT-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-[2-(4-Formylphenoxy)ethoxy]ethoxy]benzaldehyde. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-[2-(4-Formylphenoxy)ethoxy]ethoxy]benzaldehyde. Following Lipinski's Rule of Five, 4-[2-[2-(4-Formylphenoxy)ethoxy]ethoxy]benzaldehyde has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[2-[2-(4-Formylphenoxy)ethoxy]ethoxy]benzaldehyde is 111550-46-0.
The molecular formula of 4-[2-[2-(4-Formylphenoxy)ethoxy]ethoxy]benzaldehyde is C18H18O5.
The molecular weight of 4-[2-[2-(4-Formylphenoxy)ethoxy]ethoxy]benzaldehyde is 314.11542 g/mol.
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