TL;DR: 2-(3,7-Dimethylocta-2,6-dien-1-yl)benzene-1,4-diol (CAS 10457-66-6) is a chemical compound with molecular formula C16H22O2 and molecular weight 246.16199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3,7-dimethylocta-2,6-dienyl)benzene-1,4-diol
Also Known As: geroquinol, Geranylhydroquinone, 2-(3,7-dimethylocta-2,6-dienyl)benzene-1,4-diol, 2-(3,7-dimethylocta-2,6-dien-1-yl)benzene-1,4-diol
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H22O2 |
| Molecular Weight | 246.16199 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 246.16199 Da |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
| SMILES | CC(=CCCC(=CCC1=C(C=CC(=C1)O)O)C)C |
| InChIKey | ZSCRTFONTNMQBL-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that 2-(3,7-Dimethylocta-2,6-dien-1-yl)benzene-1,4-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 2-(3,7-Dimethylocta-2,6-dien-1-yl)benzene-1,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,7-Dimethylocta-2,6-dien-1-yl)benzene-1,4-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(3,7-Dimethylocta-2,6-dien-1-yl)benzene-1,4-diol is 10457-66-6.
The molecular formula of 2-(3,7-Dimethylocta-2,6-dien-1-yl)benzene-1,4-diol is C16H22O2.
The molecular weight of 2-(3,7-Dimethylocta-2,6-dien-1-yl)benzene-1,4-diol is 246.16199 g/mol.
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