TL;DR: (2-Bromo-4,6-dichlorophenyl) acetate (CAS 102932-06-9) is a chemical compound with molecular formula C8H5BrCl2O2 and molecular weight 281.885 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-bromo-4,6-dichlorophenyl) acetate
Also Known As: (2-bromo-4,6-dichlorophenyl) acetate, 2-bromo-4,6-dichlorophenyl acetate, Phenol,2-bromo-4,6-dichloro-, acetate (9CI), (2-bromo-4,6-dichloro-phenyl) Acetate, Phenol, 2-bromo-4,6-dichloro-, acetate
| Molecular Formula | C8H5BrCl2O2 |
| Molecular Weight | 281.885 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.885 Da |
| Heavy Atoms | 13 |
| Complexity | 201.0 |
| SMILES | CC(=O)OC1=C(C=C(C=C1Br)Cl)Cl |
| InChIKey | IJMDWFGJOLVEJO-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that (2-Bromo-4,6-dichlorophenyl) acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (2-Bromo-4,6-dichlorophenyl) acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Bromo-4,6-dichlorophenyl) acetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2-Bromo-4,6-dichlorophenyl) acetate is 102932-06-9.
The molecular formula of (2-Bromo-4,6-dichlorophenyl) acetate is C8H5BrCl2O2.
The molecular weight of (2-Bromo-4,6-dichlorophenyl) acetate is 281.885 g/mol.
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