(4-chlorophenyl)-triphenylphosphanium;silicic acid

C24H23ClO4PSi+ — CID 88685477

IUPAC(4-chlorophenyl)-triphenylphosphanium;silicic acid
SMILESClc1ccc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.O[Si](O)(O)O
InChIInChI=1S/C24H19ClP.H4O4Si/c25-20-16-18-24(19-17-20)26(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23;1-5(2,3)4/h1-19H;1-4H/q+1;
InChIKeyRIBBCNOKZFFMNZ-UHFFFAOYSA-N
MW469.96 g/mol
LogP2.35
Rot. Bonds4

About (4-chlorophenyl)-triphenylphosphanium;silicic acid

(4-chlorophenyl)-triphenylphosphanium;silicic acid (PubChem CID 88685477) has the molecular formula C24H23ClO4PSi+ and a molecular weight of 469.96 g/mol. Its IUPAC name is (4-chlorophenyl)-triphenylphosphanium;silicic acid.

Molecular Properties

Compound Name(4-chlorophenyl)-triphenylphosphanium;silicic acid
PubChem CID88685477
Molecular FormulaC24H23ClO4PSi+
Molecular Weight469.96 g/mol
Exact Mass469.08
IUPAC Name(4-chlorophenyl)-triphenylphosphanium;silicic acid
SMILESClc1ccc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.O[Si](O)(O)O
InChIInChI=1S/C24H19ClP.H4O4Si/c25-20-16-18-24(19-17-20)26(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23;1-5(2,3)4/h1-19H;1-4H/q+1;
InChIKeyRIBBCNOKZFFMNZ-UHFFFAOYSA-N
XLogP2.35
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500469.96
LogP ≤ 52.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-triphenylphosphanium;silicic acid?
The IUPAC name of (4-chlorophenyl)-triphenylphosphanium;silicic acid (CID 88685477) is (4-chlorophenyl)-triphenylphosphanium;silicic acid.
What is the SMILES notation for (4-chlorophenyl)-triphenylphosphanium;silicic acid?
The canonical SMILES for (4-chlorophenyl)-triphenylphosphanium;silicic acid is Clc1ccc([P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.O[Si](O)(O)O.
What is the InChIKey of (4-chlorophenyl)-triphenylphosphanium;silicic acid?
The InChIKey is RIBBCNOKZFFMNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClP.H4O4Si/c25-20-16-18-24(19-17-20)26(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23;1-5(2,3)4/h1-19H;1-4H/q+1;.
What are the key properties of (4-chlorophenyl)-triphenylphosphanium;silicic acid?
(4-chlorophenyl)-triphenylphosphanium;silicic acid has a molecular weight of 469.96 g/mol, XLogP of 2.35, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-triphenylphosphanium;silicic acid is sourced from PubChem (CID 88685477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).