TL;DR: Benzene, 1,2-dibromo-4,5-diethoxy- (CAS 118132-02-8) is a chemical compound with molecular formula C10H12Br2O2 and molecular weight 321.9204 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-dibromo-4,5-diethoxybenzene
Also Known As: 1,2-dibromo-4,5-diethoxybenzene, Benzene, 1,2-dibromo-4,5-diethoxy-, 1,2-dibromo-4,5-diethoxy-benzene, Benzene,1,2-dibromo-4,5-diethoxy, H78374
| Molecular Formula | C10H12Br2O2 |
| Molecular Weight | 321.9204 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.9204 Da |
| Heavy Atoms | 14 |
| Complexity | 148.0 |
| SMILES | CCOC1=CC(=C(C=C1OCC)Br)Br |
| InChIKey | PKWYUQFIMHXESJ-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that Benzene, 1,2-dibromo-4,5-diethoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Benzene, 1,2-dibromo-4,5-diethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,2-dibromo-4,5-diethoxy- 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 Benzene, 1,2-dibromo-4,5-diethoxy- is 118132-02-8.
The molecular formula of Benzene, 1,2-dibromo-4,5-diethoxy- is C10H12Br2O2.
The molecular weight of Benzene, 1,2-dibromo-4,5-diethoxy- is 321.9204 g/mol.
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