About 4-[2-(4-phenylphenyl)ethenyl]phenol
4-[2-(4-phenylphenyl)ethenyl]phenol (PubChem CID 73178657) has the molecular formula C20H16O
and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-[2-(4-phenylphenyl)ethenyl]phenol.
Molecular Properties
| Compound Name | 4-[2-(4-phenylphenyl)ethenyl]phenol |
| PubChem CID | 73178657 |
| Molecular Formula | C20H16O |
| Molecular Weight | 272.35 g/mol |
| Exact Mass | 272.12 |
| IUPAC Name | 4-[2-(4-phenylphenyl)ethenyl]phenol |
| SMILES | Oc1ccc(C=Cc2ccc(-c3ccccc3)cc2)cc1 |
| InChI | InChI=1S/C20H16O/c21-20-14-10-17(11-15-20)7-6-16-8-12-19(13-9-16)18-4-2-1-3-5-18/h1-15,21H |
| InChIKey | YWINJEIDYMUVHE-UHFFFAOYSA-N |
| XLogP | 5.23 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 272.35 |
| LogP ≤ 5 | 5.23 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'stilbene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 4-[2-(4-phenylphenyl)ethenyl]phenol?
The IUPAC name of 4-[2-(4-phenylphenyl)ethenyl]phenol (CID 73178657) is 4-[2-(4-phenylphenyl)ethenyl]phenol.
What is the SMILES notation for 4-[2-(4-phenylphenyl)ethenyl]phenol?
The canonical SMILES for 4-[2-(4-phenylphenyl)ethenyl]phenol is Oc1ccc(C=Cc2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of 4-[2-(4-phenylphenyl)ethenyl]phenol?
The InChIKey is YWINJEIDYMUVHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16O/c21-20-14-10-17(11-15-20)7-6-16-8-12-19(13-9-16)18-4-2-1-3-5-18/h1-15,21H.
What are the key properties of 4-[2-(4-phenylphenyl)ethenyl]phenol?
4-[2-(4-phenylphenyl)ethenyl]phenol has a molecular weight of 272.35 g/mol, XLogP of 5.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-phenylphenyl)ethenyl]phenol is sourced from PubChem (CID 73178657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).