About 1-fluoro-4-(4-phenylphenyl)naphthalene
1-fluoro-4-(4-phenylphenyl)naphthalene (PubChem CID 165394983) has the molecular formula C22H15F
and a molecular weight of 298.36 g/mol. Its IUPAC name is 1-fluoro-4-(4-phenylphenyl)naphthalene.
Molecular Properties
| Compound Name | 1-fluoro-4-(4-phenylphenyl)naphthalene |
| PubChem CID | 165394983 |
| Molecular Formula | C22H15F |
| Molecular Weight | 298.36 g/mol |
| Exact Mass | 298.12 |
| IUPAC Name | 1-fluoro-4-(4-phenylphenyl)naphthalene |
| SMILES | Fc1ccc(-c2ccc(-c3ccccc3)cc2)c2ccccc12 |
| InChI | InChI=1S/C22H15F/c23-22-15-14-19(20-8-4-5-9-21(20)22)18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-15H |
| InChIKey | KFNLJEPPANGRHZ-UHFFFAOYSA-N |
| XLogP | 6.31 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 298.36 |
| LogP ≤ 5 | 6.31 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of 1-fluoro-4-(4-phenylphenyl)naphthalene?
The IUPAC name of 1-fluoro-4-(4-phenylphenyl)naphthalene (CID 165394983) is 1-fluoro-4-(4-phenylphenyl)naphthalene.
What is the SMILES notation for 1-fluoro-4-(4-phenylphenyl)naphthalene?
The canonical SMILES for 1-fluoro-4-(4-phenylphenyl)naphthalene is Fc1ccc(-c2ccc(-c3ccccc3)cc2)c2ccccc12.
What is the InChIKey of 1-fluoro-4-(4-phenylphenyl)naphthalene?
The InChIKey is KFNLJEPPANGRHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15F/c23-22-15-14-19(20-8-4-5-9-21(20)22)18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-15H.
What are the key properties of 1-fluoro-4-(4-phenylphenyl)naphthalene?
1-fluoro-4-(4-phenylphenyl)naphthalene has a molecular weight of 298.36 g/mol, XLogP of 6.31, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-(4-phenylphenyl)naphthalene is sourced from PubChem (CID 165394983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).