TL;DR: 3-Methoxy-4-(2-methoxyethoxy)benzaldehyde (CAS 114991-70-7) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methoxy-4-(2-methoxyethoxy)benzaldehyde
Also Known As: 3-methoxy-4-(2-methoxyethoxy)benzaldehyde, 3-Methoxy-4-(2-methoxy-ethoxy)-benzaldehyde, BAS 12781479, BB 0217639, A1-00964
| Molecular Formula | C11H14O4 |
| Molecular Weight | 210.0892 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.0892 Da |
| Heavy Atoms | 15 |
| Complexity | 183.0 |
| SMILES | COCCOC1=C(C=C(C=C1)C=O)OC |
| InChIKey | NOPUZJCDDPDODF-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-4-(2-methoxyethoxy)benzaldehyde. With a topological polar surface area (TPSA) of 44.8 Ų, 3-Methoxy-4-(2-methoxyethoxy)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-4-(2-methoxyethoxy)benzaldehyde has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Methoxy-4-(2-methoxyethoxy)benzaldehyde is 114991-70-7.
The molecular formula of 3-Methoxy-4-(2-methoxyethoxy)benzaldehyde is C11H14O4.
The molecular weight of 3-Methoxy-4-(2-methoxyethoxy)benzaldehyde is 210.0892 g/mol.
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