About 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol
2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol (PubChem CID 103844538) has the molecular formula C17H20O2
and a molecular weight of 256.34 g/mol. Its IUPAC name is 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol.
Molecular Properties
| Compound Name | 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol |
| PubChem CID | 103844538 |
| Molecular Formula | C17H20O2 |
| Molecular Weight | 256.34 g/mol |
| Exact Mass | 256.15 |
| IUPAC Name | 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol |
| SMILES | CCc1ccc(COc2ccc(CCO)cc2)cc1 |
| InChI | InChI=1S/C17H20O2/c1-2-14-3-5-16(6-4-14)13-19-17-9-7-15(8-10-17)11-12-18/h3-10,18H,2,11-13H2,1H3 |
| InChIKey | AKMVWYUXQLTGFI-UHFFFAOYSA-N |
| XLogP | 3.36 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.34 |
| LogP ≤ 5 | 3.36 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol?
The IUPAC name of 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol (CID 103844538) is 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol.
What is the SMILES notation for 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol?
The canonical SMILES for 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol is CCc1ccc(COc2ccc(CCO)cc2)cc1.
What is the InChIKey of 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol?
The InChIKey is AKMVWYUXQLTGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-2-14-3-5-16(6-4-14)13-19-17-9-7-15(8-10-17)11-12-18/h3-10,18H,2,11-13H2,1H3.
What are the key properties of 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol?
2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol has a molecular weight of 256.34 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-ethylphenyl)methoxy]phenyl]ethanol is sourced from PubChem (CID 103844538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).