About 2-(4-methoxyphenoxy)phenol
2-(4-methoxyphenoxy)phenol (PubChem CID 54145402) has the molecular formula C13H12O3
and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)phenol.
Molecular Properties
| Compound Name | 2-(4-methoxyphenoxy)phenol |
| PubChem CID | 54145402 |
| Molecular Formula | C13H12O3 |
| Molecular Weight | 216.24 g/mol |
| Exact Mass | 216.08 |
| IUPAC Name | 2-(4-methoxyphenoxy)phenol |
| SMILES | COc1ccc(Oc2ccccc2O)cc1 |
| InChI | InChI=1S/C13H12O3/c1-15-10-6-8-11(9-7-10)16-13-5-3-2-4-12(13)14/h2-9,14H,1H3 |
| InChIKey | OEAKAKPPUNQBKN-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 38.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 216.24 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-methoxyphenoxy)phenol?
The IUPAC name of 2-(4-methoxyphenoxy)phenol (CID 54145402) is 2-(4-methoxyphenoxy)phenol.
What is the SMILES notation for 2-(4-methoxyphenoxy)phenol?
The canonical SMILES for 2-(4-methoxyphenoxy)phenol is COc1ccc(Oc2ccccc2O)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)phenol?
The InChIKey is OEAKAKPPUNQBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O3/c1-15-10-6-8-11(9-7-10)16-13-5-3-2-4-12(13)14/h2-9,14H,1H3.
What are the key properties of 2-(4-methoxyphenoxy)phenol?
2-(4-methoxyphenoxy)phenol has a molecular weight of 216.24 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)phenol is sourced from PubChem (CID 54145402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).