About 2-methoxy-5-[(Z)-2-phenylethenyl]phenol
2-methoxy-5-[(Z)-2-phenylethenyl]phenol (PubChem CID 6473980) has the molecular formula C15H14O2
and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-methoxy-5-[(Z)-2-phenylethenyl]phenol.
Molecular Properties
| Compound Name | 2-methoxy-5-[(Z)-2-phenylethenyl]phenol |
| PubChem CID | 6473980 |
| Molecular Formula | C15H14O2 |
| Molecular Weight | 226.28 g/mol |
| Exact Mass | 226.10 |
| IUPAC Name | 2-methoxy-5-[(Z)-2-phenylethenyl]phenol |
| SMILES | COc1ccc(/C=C\c2ccccc2)cc1O |
| InChI | InChI=1S/C15H14O2/c1-17-15-10-9-13(11-14(15)16)8-7-12-5-3-2-4-6-12/h2-11,16H,1H3/b8-7- |
| InChIKey | QVPJESIABXRENB-FPLPWBNLSA-N |
| XLogP | 3.57 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.28 |
| LogP ≤ 5 | 3.57 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'stilbene', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-5-[(Z)-2-phenylethenyl]phenol?
The IUPAC name of 2-methoxy-5-[(Z)-2-phenylethenyl]phenol (CID 6473980) is 2-methoxy-5-[(Z)-2-phenylethenyl]phenol.
What is the SMILES notation for 2-methoxy-5-[(Z)-2-phenylethenyl]phenol?
The canonical SMILES for 2-methoxy-5-[(Z)-2-phenylethenyl]phenol is COc1ccc(/C=C\c2ccccc2)cc1O.
What is the InChIKey of 2-methoxy-5-[(Z)-2-phenylethenyl]phenol?
The InChIKey is QVPJESIABXRENB-FPLPWBNLSA-N. The full InChI is InChI=1S/C15H14O2/c1-17-15-10-9-13(11-14(15)16)8-7-12-5-3-2-4-6-12/h2-11,16H,1H3/b8-7-.
What are the key properties of 2-methoxy-5-[(Z)-2-phenylethenyl]phenol?
2-methoxy-5-[(Z)-2-phenylethenyl]phenol has a molecular weight of 226.28 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[(Z)-2-phenylethenyl]phenol is sourced from PubChem (CID 6473980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).