2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide

C21H21IPSi+ — CID 126959609

IUPAC2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide
SMILESC#[Si]CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.I
InChIInChI=1S/C21H20PSi.HI/c1-23-18-17-22(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21;/h1-16H,17-18H2;1H/q+1;
InChIKeyJMUABXJWJQEHCB-UHFFFAOYSA-N
MW459.36 g/mol
LogP4.31
Rot. Bonds5

About 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide

2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide (PubChem CID 126959609) has the molecular formula C21H21IPSi+ and a molecular weight of 459.36 g/mol. Its IUPAC name is 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide.

Molecular Properties

Compound Name2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide
PubChem CID126959609
Molecular FormulaC21H21IPSi+
Molecular Weight459.36 g/mol
Exact Mass459.02
IUPAC Name2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide
SMILESC#[Si]CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.I
InChIInChI=1S/C21H20PSi.HI/c1-23-18-17-22(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21;/h1-16H,17-18H2;1H/q+1;
InChIKeyJMUABXJWJQEHCB-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500459.36
LogP ≤ 54.31
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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Related Compounds

palladium;triphenyl(2-triphenylphosphaniumylethyl)phosphanium
CID 87290696
triphenyl(2-triphenylphosphaniumylethyl)phosphanium dibromide
CID 2785215
triphenyl(3-triphenylphosphaniumylpropyl)phosphanium;hydrobromide
CID 22210440
triphenyl(7-triphenylphosphaniumylheptyl)phosphanium dibromide
CID 19082496
4-iodobutyl(triphenyl)phosphanium
CID 16760510
triphenyl(2-triphenylphosphaniumylethyl)phosphanium diperiodate
CID 139080930
2-hydroxyethyl(triphenyl)phosphanium bromide
CID 2733550
triphenyl(propyl)phosphanium;hydrochloride
CID 118516578
3,3-dimethoxypropyl(triphenyl)phosphanium
CID 10621039
triphenyl(2-phenylethyl)phosphanium chloride
CID 88746248
4-fluorobutyl(triphenyl)phosphanium
CID 21187191
2-(N-methylanilino)ethyl-triphenylphosphanium
CID 71322750

Frequently Asked Questions

What is the IUPAC name of 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide?
The IUPAC name of 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide (CID 126959609) is 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide.
What is the SMILES notation for 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide?
The canonical SMILES for 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide is C#[Si]CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.I.
What is the InChIKey of 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide?
The InChIKey is JMUABXJWJQEHCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20PSi.HI/c1-23-18-17-22(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21;/h1-16H,17-18H2;1H/q+1;.
What are the key properties of 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide?
2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide has a molecular weight of 459.36 g/mol, XLogP of 4.31, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidynesilylethyl(triphenyl)phosphanium;hydroiodide is sourced from PubChem (CID 126959609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).