About 6-methoxy-2-methyl-1-benzofuran-4-ol
6-methoxy-2-methyl-1-benzofuran-4-ol (PubChem CID 23253009) has the molecular formula C10H10O3
and a molecular weight of 178.19 g/mol. Its IUPAC name is 6-methoxy-2-methyl-1-benzofuran-4-ol.
Molecular Properties
| Compound Name | 6-methoxy-2-methyl-1-benzofuran-4-ol |
| PubChem CID | 23253009 |
| Molecular Formula | C10H10O3 |
| Molecular Weight | 178.19 g/mol |
| Exact Mass | 178.06 |
| IUPAC Name | 6-methoxy-2-methyl-1-benzofuran-4-ol |
| SMILES | COc1cc(O)c2cc(C)oc2c1 |
| InChI | InChI=1S/C10H10O3/c1-6-3-8-9(11)4-7(12-2)5-10(8)13-6/h3-5,11H,1-2H3 |
| InChIKey | KRXCPMFHPLNYKG-UHFFFAOYSA-N |
| XLogP | 2.46 |
| TPSA | 42.60 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 178.19 |
| LogP ≤ 5 | 2.46 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-methoxy-2-methyl-1-benzofuran-4-ol?
The IUPAC name of 6-methoxy-2-methyl-1-benzofuran-4-ol (CID 23253009) is 6-methoxy-2-methyl-1-benzofuran-4-ol.
What is the SMILES notation for 6-methoxy-2-methyl-1-benzofuran-4-ol?
The canonical SMILES for 6-methoxy-2-methyl-1-benzofuran-4-ol is COc1cc(O)c2cc(C)oc2c1.
What is the InChIKey of 6-methoxy-2-methyl-1-benzofuran-4-ol?
The InChIKey is KRXCPMFHPLNYKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O3/c1-6-3-8-9(11)4-7(12-2)5-10(8)13-6/h3-5,11H,1-2H3.
What are the key properties of 6-methoxy-2-methyl-1-benzofuran-4-ol?
6-methoxy-2-methyl-1-benzofuran-4-ol has a molecular weight of 178.19 g/mol, XLogP of 2.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methyl-1-benzofuran-4-ol is sourced from PubChem (CID 23253009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).