TL;DR: [2-(Acetyloxy)-5-methylphenyl]phenylmethanone (CAS 135564-55-5) is a chemical compound with molecular formula C16H14O3 and molecular weight 254.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-benzoyl-4-methylphenyl) acetate
Also Known As: 2-(acetyloxy)-5-methylbenzophenone, 2-Benzoyl-4-methylphenyl acetate, (2-benzoyl-4-methylphenyl) acetate, (2-benzoyl-4-methyl-phenyl) Acetate, [2-(Acetyloxy)-5-methylphenyl]phenylmethanone
| Molecular Formula | C16H14O3 |
| Molecular Weight | 254.0943 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.0943 Da |
| Heavy Atoms | 19 |
| Complexity | 331.0 |
| SMILES | CC1=CC(=C(C=C1)OC(=O)C)C(=O)C2=CC=CC=C2 |
| InChIKey | NBCDKERCQXODCW-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that [2-(Acetyloxy)-5-methylphenyl]phenylmethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, [2-(Acetyloxy)-5-methylphenyl]phenylmethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(Acetyloxy)-5-methylphenyl]phenylmethanone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [2-(Acetyloxy)-5-methylphenyl]phenylmethanone is 135564-55-5.
The molecular formula of [2-(Acetyloxy)-5-methylphenyl]phenylmethanone is C16H14O3.
The molecular weight of [2-(Acetyloxy)-5-methylphenyl]phenylmethanone is 254.0943 g/mol.
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