About 2-diphenylphosphanyl-6-methoxyphenol
2-diphenylphosphanyl-6-methoxyphenol (PubChem CID 58759318) has the molecular formula C19H17O2P
and a molecular weight of 308.32 g/mol. Its IUPAC name is 2-diphenylphosphanyl-6-methoxyphenol.
Molecular Properties
| Compound Name | 2-diphenylphosphanyl-6-methoxyphenol |
| PubChem CID | 58759318 |
| Molecular Formula | C19H17O2P |
| Molecular Weight | 308.32 g/mol |
| Exact Mass | 308.10 |
| IUPAC Name | 2-diphenylphosphanyl-6-methoxyphenol |
| SMILES | COc1cccc(P(c2ccccc2)c2ccccc2)c1O |
| InChI | InChI=1S/C19H17O2P/c1-21-17-13-8-14-18(19(17)20)22(15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-14,20H,1H3 |
| InChIKey | FSURXWITBAQNTC-UHFFFAOYSA-N |
| XLogP | 3.16 |
| TPSA | 29.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 308.32 |
| LogP ≤ 5 | 3.16 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-diphenylphosphanyl-6-methoxyphenol?
The IUPAC name of 2-diphenylphosphanyl-6-methoxyphenol (CID 58759318) is 2-diphenylphosphanyl-6-methoxyphenol.
What is the SMILES notation for 2-diphenylphosphanyl-6-methoxyphenol?
The canonical SMILES for 2-diphenylphosphanyl-6-methoxyphenol is COc1cccc(P(c2ccccc2)c2ccccc2)c1O.
What is the InChIKey of 2-diphenylphosphanyl-6-methoxyphenol?
The InChIKey is FSURXWITBAQNTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17O2P/c1-21-17-13-8-14-18(19(17)20)22(15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-14,20H,1H3.
What are the key properties of 2-diphenylphosphanyl-6-methoxyphenol?
2-diphenylphosphanyl-6-methoxyphenol has a molecular weight of 308.32 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphanyl-6-methoxyphenol is sourced from PubChem (CID 58759318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).