About methoxy-(2-methylphenoxy)-phenylphosphane
methoxy-(2-methylphenoxy)-phenylphosphane (PubChem CID 174536732) has the molecular formula C14H15O2P
and a molecular weight of 246.25 g/mol. Its IUPAC name is methoxy-(2-methylphenoxy)-phenylphosphane.
Molecular Properties
| Compound Name | methoxy-(2-methylphenoxy)-phenylphosphane |
| PubChem CID | 174536732 |
| Molecular Formula | C14H15O2P |
| Molecular Weight | 246.25 g/mol |
| Exact Mass | 246.08 |
| IUPAC Name | methoxy-(2-methylphenoxy)-phenylphosphane |
| SMILES | COP(Oc1ccccc1C)c1ccccc1 |
| InChI | InChI=1S/C14H15O2P/c1-12-8-6-7-11-14(12)16-17(15-2)13-9-4-3-5-10-13/h3-11H,1-2H3 |
| InChIKey | PBQOACHYFYEIFN-UHFFFAOYSA-N |
| XLogP | 3.66 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 246.25 |
| LogP ≤ 5 | 3.66 |
| H-Bond Donors ≤ 5 | 0 |
| 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 methoxy-(2-methylphenoxy)-phenylphosphane?
The IUPAC name of methoxy-(2-methylphenoxy)-phenylphosphane (CID 174536732) is methoxy-(2-methylphenoxy)-phenylphosphane.
What is the SMILES notation for methoxy-(2-methylphenoxy)-phenylphosphane?
The canonical SMILES for methoxy-(2-methylphenoxy)-phenylphosphane is COP(Oc1ccccc1C)c1ccccc1.
What is the InChIKey of methoxy-(2-methylphenoxy)-phenylphosphane?
The InChIKey is PBQOACHYFYEIFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15O2P/c1-12-8-6-7-11-14(12)16-17(15-2)13-9-4-3-5-10-13/h3-11H,1-2H3.
What are the key properties of methoxy-(2-methylphenoxy)-phenylphosphane?
methoxy-(2-methylphenoxy)-phenylphosphane has a molecular weight of 246.25 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-(2-methylphenoxy)-phenylphosphane is sourced from PubChem (CID 174536732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).