TL;DR: 1,4-Benzenediol, 2,5-dioctyl- (CAS 10551-36-7) is a chemical compound with molecular formula C22H38O2 and molecular weight 334.28717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5-dioctylbenzene-1,4-diol
Also Known As: 2,5-Dioctylhydroquinone, 1,4-Benzenediol, 2,5-dioctyl-, 2,5-dioctylbenzene-1,4-diol, 2,5-Dioctyl-1,4-benzenediol, 1,4-Benzenediol,2,5-dioctyl
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H38O2 |
| Molecular Weight | 334.28717 g/mol |
| XLogP | 9.3 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 334.28717 Da |
| Heavy Atoms | 24 |
| Complexity | 251.0 |
| SMILES | CCCCCCCCC1=CC(=C(C=C1O)CCCCCCCC)O |
| InChIKey | QVLXDGDLLZYJAM-UHFFFAOYSA-N |
The XLogP value of 9.3 indicates that 1,4-Benzenediol, 2,5-dioctyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 1,4-Benzenediol, 2,5-dioctyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzenediol, 2,5-dioctyl- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,4-Benzenediol, 2,5-dioctyl- is 10551-36-7.
The molecular formula of 1,4-Benzenediol, 2,5-dioctyl- is C22H38O2.
The molecular weight of 1,4-Benzenediol, 2,5-dioctyl- is 334.28717 g/mol.
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