TL;DR: 2-(4-Pentylbenzoyl)-1-benzofuran-5-carbaldehyde (CAS 300665-10-5) is a chemical compound with molecular formula C21H20O3 and molecular weight 320.14124 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-pentylbenzoyl)-1-benzofuran-5-carbaldehyde
Also Known As: ZINCBORATE3.5HYDRATE, 2-(4-pentylbenzoyl)-1-benzofuran-5-carbaldehyde, 2-(4-Pentylbenzoyl)benzofuran-5-carbaldehyde, 5-Benzofurancarboxaldehyde,2-(4-pentylbenzoyl)-, 2-(4-PentYl-Benzoyl)-1-Benzofuran-5-Carbaldehyde
| Molecular Formula | C21H20O3 |
| Molecular Weight | 320.14124 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 320.14124 Da |
| Heavy Atoms | 24 |
| Complexity | 425.0 |
| SMILES | CCCCCC1=CC=C(C=C1)C(=O)C2=CC3=C(O2)C=CC(=C3)C=O |
| InChIKey | GJTUOBWRJOLPGS-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that 2-(4-Pentylbenzoyl)-1-benzofuran-5-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.3 Ų, 2-(4-Pentylbenzoyl)-1-benzofuran-5-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Pentylbenzoyl)-1-benzofuran-5-carbaldehyde has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(4-Pentylbenzoyl)-1-benzofuran-5-carbaldehyde is 300665-10-5.
The molecular formula of 2-(4-Pentylbenzoyl)-1-benzofuran-5-carbaldehyde is C21H20O3.
The molecular weight of 2-(4-Pentylbenzoyl)-1-benzofuran-5-carbaldehyde is 320.14124 g/mol.
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