TL;DR: 2,6-Difluoro-3-hydroxybenzaldehyde (CAS 152434-88-3) is a chemical compound with molecular formula C7H4F2O2 and molecular weight 158.01793 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-difluoro-3-hydroxybenzaldehyde
Also Known As: 2,6-Difluoro-3-hydroxybenzaldehyde, 2,4-Difluoro-3-formylphenol, 2,6-difluoro-3-hydroxy-benzaldehyde, Benzaldehyde,2,6-difluoro-3-hydroxy-, Benzaldehyde, 2,6-difluoro-3-hydroxy-
| Molecular Formula | C7H4F2O2 |
| Molecular Weight | 158.01793 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.01793 Da |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
| SMILES | C1=CC(=C(C(=C1O)F)C=O)F |
| InChIKey | NHGSYGIEJAONJB-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Difluoro-3-hydroxybenzaldehyde. With a topological polar surface area (TPSA) of 37.3 Ų, 2,6-Difluoro-3-hydroxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Difluoro-3-hydroxybenzaldehyde 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 2,6-Difluoro-3-hydroxybenzaldehyde is 152434-88-3.
The molecular formula of 2,6-Difluoro-3-hydroxybenzaldehyde is C7H4F2O2.
The molecular weight of 2,6-Difluoro-3-hydroxybenzaldehyde is 158.01793 g/mol.
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