About bis(2-fluoro-4-methoxyphenyl)methanol
bis(2-fluoro-4-methoxyphenyl)methanol (PubChem CID 102884350) has the molecular formula C15H14F2O3
and a molecular weight of 280.27 g/mol. Its IUPAC name is bis(2-fluoro-4-methoxyphenyl)methanol.
Molecular Properties
| Compound Name | bis(2-fluoro-4-methoxyphenyl)methanol |
| PubChem CID | 102884350 |
| Molecular Formula | C15H14F2O3 |
| Molecular Weight | 280.27 g/mol |
| Exact Mass | 280.09 |
| IUPAC Name | bis(2-fluoro-4-methoxyphenyl)methanol |
| SMILES | COc1ccc(C(O)c2ccc(OC)cc2F)c(F)c1 |
| InChI | InChI=1S/C15H14F2O3/c1-19-9-3-5-11(13(16)7-9)15(18)12-6-4-10(20-2)8-14(12)17/h3-8,15,18H,1-2H3 |
| InChIKey | PIEIZOVHHXVGDQ-UHFFFAOYSA-N |
| XLogP | 3.06 |
| TPSA | 38.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.27 |
| LogP ≤ 5 | 3.06 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of bis(2-fluoro-4-methoxyphenyl)methanol?
The IUPAC name of bis(2-fluoro-4-methoxyphenyl)methanol (CID 102884350) is bis(2-fluoro-4-methoxyphenyl)methanol.
What is the SMILES notation for bis(2-fluoro-4-methoxyphenyl)methanol?
The canonical SMILES for bis(2-fluoro-4-methoxyphenyl)methanol is COc1ccc(C(O)c2ccc(OC)cc2F)c(F)c1.
What is the InChIKey of bis(2-fluoro-4-methoxyphenyl)methanol?
The InChIKey is PIEIZOVHHXVGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O3/c1-19-9-3-5-11(13(16)7-9)15(18)12-6-4-10(20-2)8-14(12)17/h3-8,15,18H,1-2H3.
What are the key properties of bis(2-fluoro-4-methoxyphenyl)methanol?
bis(2-fluoro-4-methoxyphenyl)methanol has a molecular weight of 280.27 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-fluoro-4-methoxyphenyl)methanol is sourced from PubChem (CID 102884350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).