TL;DR: 2-[Bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol (CAS 151561-67-0) is a chemical compound with molecular formula C17H14Br2O3 and molecular weight 423.93097 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol
Also Known As: BAS 00612938, BIM-0013528.P001, 2-[bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol, 2-(bis(5-methylfuran-2-yl)methyl)-4,6-dibromophenol, 2-[bis(5-methyl(2-furyl))methyl]-4,6-dibromophenol
| Molecular Formula | C17H14Br2O3 |
| Molecular Weight | 423.93097 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.93097 Da |
| Heavy Atoms | 22 |
| Complexity | 361.0 |
| SMILES | CC1=CC=C(O1)C(C2=CC=C(O2)C)C3=C(C(=CC(=C3)Br)Br)O |
| InChIKey | OIQPXZWSWPFLOS-UHFFFAOYSA-N |
The XLogP value of 5.3 indicates that 2-[Bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2-[Bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[Bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-[Bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol is 151561-67-0.
The molecular formula of 2-[Bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol is C17H14Br2O3.
The molecular weight of 2-[Bis(5-methylfuran-2-yl)methyl]-4,6-dibromophenol is 423.93097 g/mol.
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