About 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene
4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene (PubChem CID 69117197) has the molecular formula C19H15FO
and a molecular weight of 278.33 g/mol. Its IUPAC name is 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene.
Molecular Properties
| Compound Name | 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene |
| PubChem CID | 69117197 |
| Molecular Formula | C19H15FO |
| Molecular Weight | 278.33 g/mol |
| Exact Mass | 278.11 |
| IUPAC Name | 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene |
| SMILES | COc1ccc(F)cc1-c1ccccc1-c1ccccc1 |
| InChI | InChI=1S/C19H15FO/c1-21-19-12-11-15(20)13-18(19)17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-13H,1H3 |
| InChIKey | UEDNXAUKTQTZSO-UHFFFAOYSA-N |
| XLogP | 5.17 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 278.33 |
| LogP ≤ 5 | 5.17 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene?
The IUPAC name of 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene (CID 69117197) is 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene.
What is the SMILES notation for 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene?
The canonical SMILES for 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene is COc1ccc(F)cc1-c1ccccc1-c1ccccc1.
What is the InChIKey of 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene?
The InChIKey is UEDNXAUKTQTZSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FO/c1-21-19-12-11-15(20)13-18(19)17-10-6-5-9-16(17)14-7-3-2-4-8-14/h2-13H,1H3.
What are the key properties of 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene?
4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene has a molecular weight of 278.33 g/mol, XLogP of 5.17, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene is sourced from PubChem (CID 69117197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).