About 4-(hydroxymethyl)-3-methoxyphenol
4-(hydroxymethyl)-3-methoxyphenol (PubChem CID 3759783) has the molecular formula C8H10O3
and a molecular weight of 154.16 g/mol. Its IUPAC name is 4-(hydroxymethyl)-3-methoxyphenol.
Molecular Properties
| Compound Name | 4-(hydroxymethyl)-3-methoxyphenol |
| PubChem CID | 3759783 |
| Molecular Formula | C8H10O3 |
| Molecular Weight | 154.16 g/mol |
| Exact Mass | 154.06 |
| IUPAC Name | 4-(hydroxymethyl)-3-methoxyphenol |
| SMILES | COc1cc(O)ccc1CO |
| InChI | InChI=1S/C8H10O3/c1-11-8-4-7(10)3-2-6(8)5-9/h2-4,9-10H,5H2,1H3 |
| InChIKey | IMPDSJJLYGGTPW-UHFFFAOYSA-N |
| XLogP | 0.89 |
| TPSA | 49.69 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 154.16 |
| LogP ≤ 5 | 0.89 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-(hydroxymethyl)-3-methoxyphenol?
The IUPAC name of 4-(hydroxymethyl)-3-methoxyphenol (CID 3759783) is 4-(hydroxymethyl)-3-methoxyphenol.
What is the SMILES notation for 4-(hydroxymethyl)-3-methoxyphenol?
The canonical SMILES for 4-(hydroxymethyl)-3-methoxyphenol is COc1cc(O)ccc1CO.
What is the InChIKey of 4-(hydroxymethyl)-3-methoxyphenol?
The InChIKey is IMPDSJJLYGGTPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O3/c1-11-8-4-7(10)3-2-6(8)5-9/h2-4,9-10H,5H2,1H3.
What are the key properties of 4-(hydroxymethyl)-3-methoxyphenol?
4-(hydroxymethyl)-3-methoxyphenol has a molecular weight of 154.16 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-3-methoxyphenol is sourced from PubChem (CID 3759783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).