About 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol
3-[5-(3-fluorophenyl)thiophen-2-yl]phenol (PubChem CID 25192480) has the molecular formula C16H11FOS
and a molecular weight of 270.33 g/mol. Its IUPAC name is 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol.
Molecular Properties
| Compound Name | 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol |
| PubChem CID | 25192480 |
| Molecular Formula | C16H11FOS |
| Molecular Weight | 270.33 g/mol |
| Exact Mass | 270.05 |
| IUPAC Name | 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol |
| SMILES | Oc1cccc(-c2ccc(-c3cccc(F)c3)s2)c1 |
| InChI | InChI=1S/C16H11FOS/c17-13-5-1-3-11(9-13)15-7-8-16(19-15)12-4-2-6-14(18)10-12/h1-10,18H |
| InChIKey | BZEWIGQYBSBQAI-UHFFFAOYSA-N |
| XLogP | 4.93 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 270.33 |
| LogP ≤ 5 | 4.93 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol?
The IUPAC name of 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol (CID 25192480) is 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol.
What is the SMILES notation for 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol?
The canonical SMILES for 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol is Oc1cccc(-c2ccc(-c3cccc(F)c3)s2)c1.
What is the InChIKey of 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol?
The InChIKey is BZEWIGQYBSBQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FOS/c17-13-5-1-3-11(9-13)15-7-8-16(19-15)12-4-2-6-14(18)10-12/h1-10,18H.
What are the key properties of 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol?
3-[5-(3-fluorophenyl)thiophen-2-yl]phenol has a molecular weight of 270.33 g/mol, XLogP of 4.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(3-fluorophenyl)thiophen-2-yl]phenol is sourced from PubChem (CID 25192480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).