About 4-methoxy-2-phenoxynaphthalen-1-ol
4-methoxy-2-phenoxynaphthalen-1-ol (PubChem CID 19872952) has the molecular formula C17H14O3
and a molecular weight of 266.30 g/mol. Its IUPAC name is 4-methoxy-2-phenoxynaphthalen-1-ol.
Molecular Properties
| Compound Name | 4-methoxy-2-phenoxynaphthalen-1-ol |
| PubChem CID | 19872952 |
| Molecular Formula | C17H14O3 |
| Molecular Weight | 266.30 g/mol |
| Exact Mass | 266.09 |
| IUPAC Name | 4-methoxy-2-phenoxynaphthalen-1-ol |
| SMILES | COc1cc(Oc2ccccc2)c(O)c2ccccc12 |
| InChI | InChI=1S/C17H14O3/c1-19-15-11-16(20-12-7-3-2-4-8-12)17(18)14-10-6-5-9-13(14)15/h2-11,18H,1H3 |
| InChIKey | XIILTIOQIRWRRT-UHFFFAOYSA-N |
| XLogP | 4.35 |
| TPSA | 38.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 266.30 |
| LogP ≤ 5 | 4.35 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-methoxy-2-phenoxynaphthalen-1-ol?
The IUPAC name of 4-methoxy-2-phenoxynaphthalen-1-ol (CID 19872952) is 4-methoxy-2-phenoxynaphthalen-1-ol.
What is the SMILES notation for 4-methoxy-2-phenoxynaphthalen-1-ol?
The canonical SMILES for 4-methoxy-2-phenoxynaphthalen-1-ol is COc1cc(Oc2ccccc2)c(O)c2ccccc12.
What is the InChIKey of 4-methoxy-2-phenoxynaphthalen-1-ol?
The InChIKey is XIILTIOQIRWRRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O3/c1-19-15-11-16(20-12-7-3-2-4-8-12)17(18)14-10-6-5-9-13(14)15/h2-11,18H,1H3.
What are the key properties of 4-methoxy-2-phenoxynaphthalen-1-ol?
4-methoxy-2-phenoxynaphthalen-1-ol has a molecular weight of 266.30 g/mol, XLogP of 4.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-phenoxynaphthalen-1-ol is sourced from PubChem (CID 19872952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).