About propan-2-yloxy(propyl)phosphinite
propan-2-yloxy(propyl)phosphinite (PubChem CID 18981653) has the molecular formula C6H14O2P-
and a molecular weight of 149.15 g/mol. Its IUPAC name is propan-2-yloxy(propyl)phosphinite.
Molecular Properties
| Compound Name | propan-2-yloxy(propyl)phosphinite |
| PubChem CID | 18981653 |
| Molecular Formula | C6H14O2P- |
| Molecular Weight | 149.15 g/mol |
| Exact Mass | 149.07 |
| IUPAC Name | propan-2-yloxy(propyl)phosphinite |
| SMILES | CCCP([O-])OC(C)C |
| InChI | InChI=1S/C6H14O2P/c1-4-5-9(7)8-6(2)3/h6H,4-5H2,1-3H3/q-1 |
| InChIKey | GCYOOMFONNHHGX-UHFFFAOYSA-N |
| XLogP | 1.49 |
| TPSA | 32.29 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 149.15 |
| LogP ≤ 5 | 1.49 |
| 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 propan-2-yloxy(propyl)phosphinite?
The IUPAC name of propan-2-yloxy(propyl)phosphinite (CID 18981653) is propan-2-yloxy(propyl)phosphinite.
What is the SMILES notation for propan-2-yloxy(propyl)phosphinite?
The canonical SMILES for propan-2-yloxy(propyl)phosphinite is CCCP([O-])OC(C)C.
What is the InChIKey of propan-2-yloxy(propyl)phosphinite?
The InChIKey is GCYOOMFONNHHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2P/c1-4-5-9(7)8-6(2)3/h6H,4-5H2,1-3H3/q-1.
What are the key properties of propan-2-yloxy(propyl)phosphinite?
propan-2-yloxy(propyl)phosphinite has a molecular weight of 149.15 g/mol, XLogP of 1.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yloxy(propyl)phosphinite is sourced from PubChem (CID 18981653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).