triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride

C24H30ClOPSi — CID 11396265

IUPACtriphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride
SMILESC[Si](C)(C)CCOC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
InChIInChI=1S/C24H30OPSi.ClH/c1-27(2,3)20-19-25-21-26(22-13-7-4-8-14-22,23-15-9-5-10-16-23)24-17-11-6-12-18-24;/h4-18H,19-21H2,1-3H3;1H/q+1;/p-1
InChIKeyNEUMNYXEDIPGJD-UHFFFAOYSA-M
MW429.02 g/mol
LogP2.30
Rot. Bonds8

About triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride

triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride (PubChem CID 11396265) has the molecular formula C24H30ClOPSi and a molecular weight of 429.02 g/mol. Its IUPAC name is triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride.

Molecular Properties

Compound Nametriphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride
PubChem CID11396265
Molecular FormulaC24H30ClOPSi
Molecular Weight429.02 g/mol
Exact Mass428.15
IUPAC Nametriphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride
SMILESC[Si](C)(C)CCOC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]
InChIInChI=1S/C24H30OPSi.ClH/c1-27(2,3)20-19-25-21-26(22-13-7-4-8-14-22,23-15-9-5-10-16-23)24-17-11-6-12-18-24;/h4-18H,19-21H2,1-3H3;1H/q+1;/p-1
InChIKeyNEUMNYXEDIPGJD-UHFFFAOYSA-M
XLogP2.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.02
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride?
The IUPAC name of triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride (CID 11396265) is triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride.
What is the SMILES notation for triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride?
The canonical SMILES for triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride is C[Si](C)(C)CCOC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Cl-].
What is the InChIKey of triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride?
The InChIKey is NEUMNYXEDIPGJD-UHFFFAOYSA-M. The full InChI is InChI=1S/C24H30OPSi.ClH/c1-27(2,3)20-19-25-21-26(22-13-7-4-8-14-22,23-15-9-5-10-16-23)24-17-11-6-12-18-24;/h4-18H,19-21H2,1-3H3;1H/q+1;/p-1.
What are the key properties of triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride?
triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride has a molecular weight of 429.02 g/mol, XLogP of 2.30, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triphenyl(2-trimethylsilylethoxymethyl)phosphanium chloride is sourced from PubChem (CID 11396265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).