tris(4-fluorophenyl)-hydroxyphosphanium

C18H13F3OP+ — CID 162372476

IUPACtris(4-fluorophenyl)-hydroxyphosphanium
SMILESO[P+](c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C18H13F3OP/c19-13-1-7-16(8-2-13)23(22,17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12,22H/q+1
InChIKeyWFEAFKXDXDEOEG-UHFFFAOYSA-N
MW333.27 g/mol
LogP3.31
Rot. Bonds3

About tris(4-fluorophenyl)-hydroxyphosphanium

tris(4-fluorophenyl)-hydroxyphosphanium (PubChem CID 162372476) has the molecular formula C18H13F3OP+ and a molecular weight of 333.27 g/mol. Its IUPAC name is tris(4-fluorophenyl)-hydroxyphosphanium.

Molecular Properties

Compound Nametris(4-fluorophenyl)-hydroxyphosphanium
PubChem CID162372476
Molecular FormulaC18H13F3OP+
Molecular Weight333.27 g/mol
Exact Mass333.07
IUPAC Nametris(4-fluorophenyl)-hydroxyphosphanium
SMILESO[P+](c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C18H13F3OP/c19-13-1-7-16(8-2-13)23(22,17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12,22H/q+1
InChIKeyWFEAFKXDXDEOEG-UHFFFAOYSA-N
XLogP3.31
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.27
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tris(4-fluorophenyl)-hydroxyphosphanium?
The IUPAC name of tris(4-fluorophenyl)-hydroxyphosphanium (CID 162372476) is tris(4-fluorophenyl)-hydroxyphosphanium.
What is the SMILES notation for tris(4-fluorophenyl)-hydroxyphosphanium?
The canonical SMILES for tris(4-fluorophenyl)-hydroxyphosphanium is O[P+](c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of tris(4-fluorophenyl)-hydroxyphosphanium?
The InChIKey is WFEAFKXDXDEOEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3OP/c19-13-1-7-16(8-2-13)23(22,17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18/h1-12,22H/q+1.
What are the key properties of tris(4-fluorophenyl)-hydroxyphosphanium?
tris(4-fluorophenyl)-hydroxyphosphanium has a molecular weight of 333.27 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tris(4-fluorophenyl)-hydroxyphosphanium is sourced from PubChem (CID 162372476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).