About tris(2,6-difluorophenyl)phosphane
tris(2,6-difluorophenyl)phosphane (PubChem CID 15876355) has the molecular formula C18H9F6P
and a molecular weight of 370.23 g/mol. Its IUPAC name is tris(2,6-difluorophenyl)phosphane.
Molecular Properties
| Compound Name | tris(2,6-difluorophenyl)phosphane |
| PubChem CID | 15876355 |
| Molecular Formula | C18H9F6P |
| Molecular Weight | 370.23 g/mol |
| Exact Mass | 370.03 |
| IUPAC Name | tris(2,6-difluorophenyl)phosphane |
| SMILES | Fc1cccc(F)c1P(c1c(F)cccc1F)c1c(F)cccc1F |
| InChI | InChI=1S/C18H9F6P/c19-10-4-1-5-11(20)16(10)25(17-12(21)6-2-7-13(17)22)18-14(23)8-3-9-15(18)24/h1-9H |
| InChIKey | CTXPXQLWCUNCNP-UHFFFAOYSA-N |
| XLogP | 4.28 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 3 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 370.23 |
| LogP ≤ 5 | 4.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
|---|
Analyze tris(2,6-difluorophenyl)phosphane with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of tris(2,6-difluorophenyl)phosphane?
The IUPAC name of tris(2,6-difluorophenyl)phosphane (CID 15876355) is tris(2,6-difluorophenyl)phosphane.
What is the SMILES notation for tris(2,6-difluorophenyl)phosphane?
The canonical SMILES for tris(2,6-difluorophenyl)phosphane is Fc1cccc(F)c1P(c1c(F)cccc1F)c1c(F)cccc1F.
What is the InChIKey of tris(2,6-difluorophenyl)phosphane?
The InChIKey is CTXPXQLWCUNCNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H9F6P/c19-10-4-1-5-11(20)16(10)25(17-12(21)6-2-7-13(17)22)18-14(23)8-3-9-15(18)24/h1-9H.
What are the key properties of tris(2,6-difluorophenyl)phosphane?
tris(2,6-difluorophenyl)phosphane has a molecular weight of 370.23 g/mol, XLogP of 4.28, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2,6-difluorophenyl)phosphane is sourced from PubChem (CID 15876355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).