TL;DR: Hydroperoxide, 1-methyl-1-(methylphenyl)ethyl (CAS 13387-56-9) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-hydroperoxypropan-2-yl)-2-methylbenzene
Also Known As: Hydroperoxide, 1-methyl-1-(methylphenyl)ethyl, 1-(o-Tolyl)-1-methylethyl hydroperoxide, 2-(2-METHYLPHENYL)PROPANE-2-PEROXOL, 1-(2-hydroperoxypropan-2-yl)-2-methylbenzene, Hydroperoxide,1-methyl-1-(methylphenyl)ethyl
| Molecular Formula | C10H14O2 |
| Molecular Weight | 166.09938 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.09938 Da |
| Heavy Atoms | 12 |
| Complexity | 143.0 |
| SMILES | CC1=CC=CC=C1C(C)(C)OO |
| InChIKey | PMHODFQTVFDQPV-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroperoxide, 1-methyl-1-(methylphenyl)ethyl. With a topological polar surface area (TPSA) of 29.5 Ų, Hydroperoxide, 1-methyl-1-(methylphenyl)ethyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydroperoxide, 1-methyl-1-(methylphenyl)ethyl has 1 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 Hydroperoxide, 1-methyl-1-(methylphenyl)ethyl is 13387-56-9.
The molecular formula of Hydroperoxide, 1-methyl-1-(methylphenyl)ethyl is C10H14O2.
The molecular weight of Hydroperoxide, 1-methyl-1-(methylphenyl)ethyl is 166.09938 g/mol.
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