TL;DR: [3-(Difluoromethoxy)phenyl]methanol (CAS 125903-81-3) is a chemical compound with molecular formula C8H8F2O2 and molecular weight 174.04924 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(difluoromethoxy)phenyl]methanol
Also Known As: 3-(Difluoromethoxy)Benzyl Alcohol, [3-(difluoromethoxy)phenyl]methanol, (3-(Difluoromethoxy)phenyl)methanol, Benzenemethanol, 3-(difluoromethoxy)-, 3-difluoromethoxybenzyl alcohol
| Molecular Formula | C8H8F2O2 |
| Molecular Weight | 174.04924 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.04924 Da |
| Heavy Atoms | 12 |
| Complexity | 130.0 |
| SMILES | C1=CC(=CC(=C1)OC(F)F)CO |
| InChIKey | BBDUCPSYPRGPGO-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-(Difluoromethoxy)phenyl]methanol. With a topological polar surface area (TPSA) of 29.5 Ų, [3-(Difluoromethoxy)phenyl]methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3-(Difluoromethoxy)phenyl]methanol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [3-(Difluoromethoxy)phenyl]methanol is 125903-81-3.
The molecular formula of [3-(Difluoromethoxy)phenyl]methanol is C8H8F2O2.
The molecular weight of [3-(Difluoromethoxy)phenyl]methanol is 174.04924 g/mol.
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