TL;DR: (3-Butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate (CAS 123332-26-3) is a chemical compound with molecular formula C19H24O3 and molecular weight 300.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate
Also Known As: (3-Butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate, 1-Naphthalenol, 3-butyl-2-ethyl-4-methoxy-, acetate, (3-butan-2-yl-2-ethyl-4-methoxy-naphthalen-1-yl) Acetate, 3-(butan-2-yl)-2-ethyl-4-methoxynaphthalen-1-yl acetate
| Molecular Formula | C19H24O3 |
| Molecular Weight | 300.17255 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 300.17255 Da |
| Heavy Atoms | 22 |
| Complexity | 368.0 |
| SMILES | CCC1=C(C2=CC=CC=C2C(=C1C(C)CC)OC)OC(=O)C |
| InChIKey | XFEOQEKXFFRPIH-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that (3-Butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, (3-Butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (3-Butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate is 123332-26-3.
The molecular formula of (3-Butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate is C19H24O3.
The molecular weight of (3-Butan-2-yl-2-ethyl-4-methoxynaphthalen-1-yl) acetate is 300.17255 g/mol.
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