TL;DR: Propanoic acid, 2-(4-phenoxyphenoxy)-, methyl ester (CAS 153472-86-7) is a chemical compound with molecular formula C16H16O4 and molecular weight 272.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(4-phenoxyphenoxy)propanoate
Also Known As: Methyl 2-(4-phenoxyphenoxy)propanoate, Propanoic acid, 2-(4-phenoxyphenoxy)-, methyl ester, 2-(4-Phenoxyphenoxy)propionic acid methyl ester
| Molecular Formula | C16H16O4 |
| Molecular Weight | 272.10486 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.10486 Da |
| Heavy Atoms | 20 |
| Complexity | 291.0 |
| SMILES | CC(C(=O)OC)OC1=CC=C(C=C1)OC2=CC=CC=C2 |
| InChIKey | NNWOVBQVNRXEJL-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that Propanoic acid, 2-(4-phenoxyphenoxy)-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Propanoic acid, 2-(4-phenoxyphenoxy)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic acid, 2-(4-phenoxyphenoxy)-, methyl ester 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 Propanoic acid, 2-(4-phenoxyphenoxy)-, methyl ester is 153472-86-7.
The molecular formula of Propanoic acid, 2-(4-phenoxyphenoxy)-, methyl ester is C16H16O4.
The molecular weight of Propanoic acid, 2-(4-phenoxyphenoxy)-, methyl ester is 272.10486 g/mol.
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