TL;DR: 2-[(2-Bromophenyl)methyl]-5-methylphenol (CAS 103878-83-7) is a chemical compound with molecular formula C14H13BrO and molecular weight 276.01498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-bromophenyl)methyl]-5-methylphenol
Also Known As: 2-[(2-bromophenyl)methyl]-5-methylphenol, 2-(2-bromobenzyl)-5-methylphenol, Phenol,2-[(2-bromophenyl)methyl]-5-methyl-
| Molecular Formula | C14H13BrO |
| Molecular Weight | 276.01498 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.01498 Da |
| Heavy Atoms | 16 |
| Complexity | 219.0 |
| SMILES | CC1=CC(=C(C=C1)CC2=CC=CC=C2Br)O |
| InChIKey | KSVMYAQKXSAKBC-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that 2-[(2-Bromophenyl)methyl]-5-methylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-[(2-Bromophenyl)methyl]-5-methylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2-Bromophenyl)methyl]-5-methylphenol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[(2-Bromophenyl)methyl]-5-methylphenol is 103878-83-7.
The molecular formula of 2-[(2-Bromophenyl)methyl]-5-methylphenol is C14H13BrO.
The molecular weight of 2-[(2-Bromophenyl)methyl]-5-methylphenol is 276.01498 g/mol.
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