TL;DR: 2-(2-Bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone (CAS 202131-29-1) is a chemical compound with molecular formula C14H11BrO4 and molecular weight 321.98407 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone
Also Known As: 2-(2-bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone, 2-(2-bromophenoxy)-1-(2,4-dihydroxyphenyl)ethan-1-one, 1-(2,4-dihydroxyphenyl)-2-(2-bromophenoxy)ethan-1-one, F3139-1345, 2-(2-BROMO-PHENOXY)-1-(2,4-DIHYDROXY-PHENYL)-ETHANONE
| Molecular Formula | C14H11BrO4 |
| Molecular Weight | 321.98407 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.98407 Da |
| Heavy Atoms | 19 |
| Complexity | 310.0 |
| SMILES | C1=CC=C(C(=C1)OCC(=O)C2=C(C=C(C=C2)O)O)Br |
| InChIKey | LDDWVJINSMJWQT-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 2-(2-Bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone. Following Lipinski's Rule of Five, 2-(2-Bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone has 2 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 2-(2-Bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone is 202131-29-1.
The molecular formula of 2-(2-Bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone is C14H11BrO4.
The molecular weight of 2-(2-Bromophenoxy)-1-(2,4-dihydroxyphenyl)ethanone is 321.98407 g/mol.
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