About 2-ethoxynaphthalene
2-ethoxynaphthalene (PubChem CID 118978197) has the molecular formula C24H24O2
and a molecular weight of 344.45 g/mol. Its IUPAC name is 2-ethoxynaphthalene.
Molecular Properties
| Compound Name | 2-ethoxynaphthalene |
| PubChem CID | 118978197 |
| Molecular Formula | C24H24O2 |
| Molecular Weight | 344.45 g/mol |
| Exact Mass | 344.18 |
| IUPAC Name | 2-ethoxynaphthalene |
| SMILES | CCOc1ccc2ccccc2c1.CCOc1ccc2ccccc2c1 |
| InChI | InChI=1S/2C12H12O/c2*1-2-13-12-8-7-10-5-3-4-6-11(10)9-12/h2*3-9H,2H2,1H3 |
| InChIKey | XPPUVWOJJXLDNH-UHFFFAOYSA-N |
| XLogP | 6.48 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 344.45 |
| LogP ≤ 5 | 6.48 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-ethoxynaphthalene?
The IUPAC name of 2-ethoxynaphthalene (CID 118978197) is 2-ethoxynaphthalene.
What is the SMILES notation for 2-ethoxynaphthalene?
The canonical SMILES for 2-ethoxynaphthalene is CCOc1ccc2ccccc2c1.CCOc1ccc2ccccc2c1.
What is the InChIKey of 2-ethoxynaphthalene?
The InChIKey is XPPUVWOJJXLDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H12O/c2*1-2-13-12-8-7-10-5-3-4-6-11(10)9-12/h2*3-9H,2H2,1H3.
What are the key properties of 2-ethoxynaphthalene?
2-ethoxynaphthalene has a molecular weight of 344.45 g/mol, XLogP of 6.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxynaphthalene is sourced from PubChem (CID 118978197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).