triphenyl(trimethylsilylmethyl)phosphanium iodide

C22H26IPSi — CID 22461619

IUPACtriphenyl(trimethylsilylmethyl)phosphanium iodide
SMILESC[Si](C)(C)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]
InChIInChI=1S/C22H26PSi.HI/c1-24(2,3)19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,19H2,1-3H3;1H/q+1;/p-1
InChIKeyPPORXBBMZZFXTB-UHFFFAOYSA-M
MW476.41 g/mol
LogP1.86
Rot. Bonds5

About triphenyl(trimethylsilylmethyl)phosphanium iodide

triphenyl(trimethylsilylmethyl)phosphanium iodide (PubChem CID 22461619) has the molecular formula C22H26IPSi and a molecular weight of 476.41 g/mol. Its IUPAC name is triphenyl(trimethylsilylmethyl)phosphanium iodide.

Molecular Properties

Compound Nametriphenyl(trimethylsilylmethyl)phosphanium iodide
PubChem CID22461619
Molecular FormulaC22H26IPSi
Molecular Weight476.41 g/mol
Exact Mass476.06
IUPAC Nametriphenyl(trimethylsilylmethyl)phosphanium iodide
SMILESC[Si](C)(C)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]
InChIInChI=1S/C22H26PSi.HI/c1-24(2,3)19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,19H2,1-3H3;1H/q+1;/p-1
InChIKeyPPORXBBMZZFXTB-UHFFFAOYSA-M
XLogP1.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.41
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triphenyl(trimethylsilylmethyl)phosphanium iodide?
The IUPAC name of triphenyl(trimethylsilylmethyl)phosphanium iodide (CID 22461619) is triphenyl(trimethylsilylmethyl)phosphanium iodide.
What is the SMILES notation for triphenyl(trimethylsilylmethyl)phosphanium iodide?
The canonical SMILES for triphenyl(trimethylsilylmethyl)phosphanium iodide is C[Si](C)(C)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-].
What is the InChIKey of triphenyl(trimethylsilylmethyl)phosphanium iodide?
The InChIKey is PPORXBBMZZFXTB-UHFFFAOYSA-M. The full InChI is InChI=1S/C22H26PSi.HI/c1-24(2,3)19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,19H2,1-3H3;1H/q+1;/p-1.
What are the key properties of triphenyl(trimethylsilylmethyl)phosphanium iodide?
triphenyl(trimethylsilylmethyl)phosphanium iodide has a molecular weight of 476.41 g/mol, XLogP of 1.86, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl(trimethylsilylmethyl)phosphanium iodide is sourced from PubChem (CID 22461619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).