About 1-(4-fluorophenyl)-2-phenylpropan-2-ol
1-(4-fluorophenyl)-2-phenylpropan-2-ol (PubChem CID 53329553) has the molecular formula C15H15FO
and a molecular weight of 230.28 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-phenylpropan-2-ol.
Molecular Properties
| Compound Name | 1-(4-fluorophenyl)-2-phenylpropan-2-ol |
| PubChem CID | 53329553 |
| Molecular Formula | C15H15FO |
| Molecular Weight | 230.28 g/mol |
| Exact Mass | 230.11 |
| IUPAC Name | 1-(4-fluorophenyl)-2-phenylpropan-2-ol |
| SMILES | CC(O)(Cc1ccc(F)cc1)c1ccccc1 |
| InChI | InChI=1S/C15H15FO/c1-15(17,13-5-3-2-4-6-13)11-12-7-9-14(16)10-8-12/h2-10,17H,11H2,1H3 |
| InChIKey | FEGBIXQKGKZMQL-UHFFFAOYSA-N |
| XLogP | 3.28 |
| 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 | 3.28 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1-(4-fluorophenyl)-2-phenylpropan-2-ol?
The IUPAC name of 1-(4-fluorophenyl)-2-phenylpropan-2-ol (CID 53329553) is 1-(4-fluorophenyl)-2-phenylpropan-2-ol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-phenylpropan-2-ol?
The canonical SMILES for 1-(4-fluorophenyl)-2-phenylpropan-2-ol is CC(O)(Cc1ccc(F)cc1)c1ccccc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-phenylpropan-2-ol?
The InChIKey is FEGBIXQKGKZMQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FO/c1-15(17,13-5-3-2-4-6-13)11-12-7-9-14(16)10-8-12/h2-10,17H,11H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-phenylpropan-2-ol?
1-(4-fluorophenyl)-2-phenylpropan-2-ol has a molecular weight of 230.28 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-phenylpropan-2-ol is sourced from PubChem (CID 53329553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).