About 4-[2-(4-fluorophenyl)propyl]phenol
4-[2-(4-fluorophenyl)propyl]phenol (PubChem CID 70071344) has the molecular formula C15H15FO
and a molecular weight of 230.28 g/mol. Its IUPAC name is 4-[2-(4-fluorophenyl)propyl]phenol.
Molecular Properties
| Compound Name | 4-[2-(4-fluorophenyl)propyl]phenol |
| PubChem CID | 70071344 |
| Molecular Formula | C15H15FO |
| Molecular Weight | 230.28 g/mol |
| Exact Mass | 230.11 |
| IUPAC Name | 4-[2-(4-fluorophenyl)propyl]phenol |
| SMILES | CC(Cc1ccc(O)cc1)c1ccc(F)cc1 |
| InChI | InChI=1S/C15H15FO/c1-11(13-4-6-14(16)7-5-13)10-12-2-8-15(17)9-3-12/h2-9,11,17H,10H2,1H3 |
| InChIKey | DSWKLKXYKGCTSQ-UHFFFAOYSA-N |
| XLogP | 3.88 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.28 |
| LogP ≤ 5 | 3.88 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-[2-(4-fluorophenyl)propyl]phenol?
The IUPAC name of 4-[2-(4-fluorophenyl)propyl]phenol (CID 70071344) is 4-[2-(4-fluorophenyl)propyl]phenol.
What is the SMILES notation for 4-[2-(4-fluorophenyl)propyl]phenol?
The canonical SMILES for 4-[2-(4-fluorophenyl)propyl]phenol is CC(Cc1ccc(O)cc1)c1ccc(F)cc1.
What is the InChIKey of 4-[2-(4-fluorophenyl)propyl]phenol?
The InChIKey is DSWKLKXYKGCTSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FO/c1-11(13-4-6-14(16)7-5-13)10-12-2-8-15(17)9-3-12/h2-9,11,17H,10H2,1H3.
What are the key properties of 4-[2-(4-fluorophenyl)propyl]phenol?
4-[2-(4-fluorophenyl)propyl]phenol has a molecular weight of 230.28 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-fluorophenyl)propyl]phenol is sourced from PubChem (CID 70071344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).