TL;DR: 2-tert-Amylanthraquinone (CAS 32588-54-8) is a chemical compound with molecular formula C19H18O2 and molecular weight 278.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-methylbutan-2-yl)anthracene-9,10-dione
Also Known As: 2-tert-Amylanthraquinone, 2-(1,1-Dimethylpropyl)anthraquinone, 2-Amylanthraquinone, 2-(tert-Pentyl)anthracene-9,10-dione, 2-tert-Pentylanthraquinone
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C19H18O2 |
| Molecular Weight | 278.13068 g/mol |
| XLogP | 5.8 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.13068 Da |
| Heavy Atoms | 21 |
| Complexity | 437.0 |
| SMILES | CCC(C)(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O |
| InChIKey | WUKWGUZTPMOXOW-UHFFFAOYSA-N |
The XLogP value of 5.8 indicates that 2-tert-Amylanthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 2-tert-Amylanthraquinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-tert-Amylanthraquinone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-tert-Amylanthraquinone is 32588-54-8.
The molecular formula of 2-tert-Amylanthraquinone is C19H18O2.
The molecular weight of 2-tert-Amylanthraquinone is 278.13068 g/mol.
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