TL;DR: Acetic acid, 2-mesityl-2-(triisobutylsiloxy)-, ethyl ester (CAS 85905-86-8) is a chemical compound with molecular formula C25H44O3Si and molecular weight 420.30597 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(2,4,6-trimethylphenyl)-2-[tris(2-methylpropyl)silyloxy]acetate
Also Known As: 2-Mesityl-2-(triisobutylsiloxy)acetic acid ethyl ester, ACETIC ACID, 2-MESITYL-2-(TRIISOBUTYLSILOXY)-, ETHYL ESTER, Benzeneacetic acid, 2,4,6-trimethyl-alpha-((tris(2-methylpropyl)silyl)oxy)-, ethyl ester, Ethyl (2,4,6-trimethylphenyl){[tris(2-methylpropyl)silyl]oxy}acetate, ethyl 2-(2,4,6-trimethylphenyl)-2-[tris(2-methylpropyl)silyloxy]acetate
| Molecular Formula | C25H44O3Si |
| Molecular Weight | 420.30597 g/mol |
| XLogP | 7.15 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 420.30597 Da |
| Heavy Atoms | 29 |
| Complexity | 450.0 |
| SMILES | CCOC(=O)C(C1=C(C=C(C=C1C)C)C)O[Si](CC(C)C)(CC(C)C)CC(C)C |
| InChIKey | BYTIEPJWYDTQQK-UHFFFAOYSA-N |
The XLogP value of 7.15 indicates that Acetic acid, 2-mesityl-2-(triisobutylsiloxy)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Acetic acid, 2-mesityl-2-(triisobutylsiloxy)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, 2-mesityl-2-(triisobutylsiloxy)-, ethyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Acetic acid, 2-mesityl-2-(triisobutylsiloxy)-, ethyl ester is 85905-86-8.
The molecular formula of Acetic acid, 2-mesityl-2-(triisobutylsiloxy)-, ethyl ester is C25H44O3Si.
The molecular weight of Acetic acid, 2-mesityl-2-(triisobutylsiloxy)-, ethyl ester is 420.30597 g/mol.
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