About [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol
[2-bis(2-methoxyphenyl)phosphanylphenyl]methanol (PubChem CID 153279008) has the molecular formula C21H21O3P
and a molecular weight of 352.37 g/mol. Its IUPAC name is [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol.
Molecular Properties
| Compound Name | [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol |
| PubChem CID | 153279008 |
| Molecular Formula | C21H21O3P |
| Molecular Weight | 352.37 g/mol |
| Exact Mass | 352.12 |
| IUPAC Name | [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol |
| SMILES | COc1ccccc1P(c1ccccc1CO)c1ccccc1OC |
| InChI | InChI=1S/C21H21O3P/c1-23-17-10-4-7-13-20(17)25(19-12-6-3-9-16(19)15-22)21-14-8-5-11-18(21)24-2/h3-14,22H,15H2,1-2H3 |
| InChIKey | YAZHQVFOKPVVMO-UHFFFAOYSA-N |
| XLogP | 2.95 |
| TPSA | 38.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 352.37 |
| LogP ≤ 5 | 2.95 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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-bis(2-methoxyphenyl)phosphanylphenyl]methanol?
The IUPAC name of [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol (CID 153279008) is [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol.
What is the SMILES notation for [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol?
The canonical SMILES for [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol is COc1ccccc1P(c1ccccc1CO)c1ccccc1OC.
What is the InChIKey of [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol?
The InChIKey is YAZHQVFOKPVVMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21O3P/c1-23-17-10-4-7-13-20(17)25(19-12-6-3-9-16(19)15-22)21-14-8-5-11-18(21)24-2/h3-14,22H,15H2,1-2H3.
What are the key properties of [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol?
[2-bis(2-methoxyphenyl)phosphanylphenyl]methanol has a molecular weight of 352.37 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-bis(2-methoxyphenyl)phosphanylphenyl]methanol is sourced from PubChem (CID 153279008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).