About 3-(2-methoxy-5-methylphenyl)phenol
3-(2-methoxy-5-methylphenyl)phenol (PubChem CID 39243395) has the molecular formula C14H14O2
and a molecular weight of 214.26 g/mol. Its IUPAC name is 3-(2-methoxy-5-methylphenyl)phenol.
Molecular Properties
| Compound Name | 3-(2-methoxy-5-methylphenyl)phenol |
| PubChem CID | 39243395 |
| Molecular Formula | C14H14O2 |
| Molecular Weight | 214.26 g/mol |
| Exact Mass | 214.10 |
| IUPAC Name | 3-(2-methoxy-5-methylphenyl)phenol |
| SMILES | COc1ccc(C)cc1-c1cccc(O)c1 |
| InChI | InChI=1S/C14H14O2/c1-10-6-7-14(16-2)13(8-10)11-4-3-5-12(15)9-11/h3-9,15H,1-2H3 |
| InChIKey | CLMOQBAVOJBDKU-UHFFFAOYSA-N |
| XLogP | 3.38 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.26 |
| LogP ≤ 5 | 3.38 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-(2-methoxy-5-methylphenyl)phenol?
The IUPAC name of 3-(2-methoxy-5-methylphenyl)phenol (CID 39243395) is 3-(2-methoxy-5-methylphenyl)phenol.
What is the SMILES notation for 3-(2-methoxy-5-methylphenyl)phenol?
The canonical SMILES for 3-(2-methoxy-5-methylphenyl)phenol is COc1ccc(C)cc1-c1cccc(O)c1.
What is the InChIKey of 3-(2-methoxy-5-methylphenyl)phenol?
The InChIKey is CLMOQBAVOJBDKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2/c1-10-6-7-14(16-2)13(8-10)11-4-3-5-12(15)9-11/h3-9,15H,1-2H3.
What are the key properties of 3-(2-methoxy-5-methylphenyl)phenol?
3-(2-methoxy-5-methylphenyl)phenol has a molecular weight of 214.26 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-5-methylphenyl)phenol is sourced from PubChem (CID 39243395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).