methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium

C22H26PSi+ — CID 86241586

IUPACmethyl-diphenyl-(2-trimethylsilylphenyl)phosphanium
SMILESC[Si](C)(C)c1ccccc1[P+](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H26PSi/c1-23(19-13-7-5-8-14-19,20-15-9-6-10-16-20)21-17-11-12-18-22(21)24(2,3)4/h5-18H,1-4H3/q+1
InChIKeyCVGACNYCGDOKTM-UHFFFAOYSA-N
MW349.51 g/mol
LogP4.16
Rot. Bonds4

About methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium

methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium (PubChem CID 86241586) has the molecular formula C22H26PSi+ and a molecular weight of 349.51 g/mol. Its IUPAC name is methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium.

Molecular Properties

Compound Namemethyl-diphenyl-(2-trimethylsilylphenyl)phosphanium
PubChem CID86241586
Molecular FormulaC22H26PSi+
Molecular Weight349.51 g/mol
Exact Mass349.15
IUPAC Namemethyl-diphenyl-(2-trimethylsilylphenyl)phosphanium
SMILESC[Si](C)(C)c1ccccc1[P+](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H26PSi/c1-23(19-13-7-5-8-14-19,20-15-9-6-10-16-20)21-17-11-12-18-22(21)24(2,3)4/h5-18H,1-4H3/q+1
InChIKeyCVGACNYCGDOKTM-UHFFFAOYSA-N
XLogP4.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.51
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium?
The IUPAC name of methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium (CID 86241586) is methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium.
What is the SMILES notation for methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium?
The canonical SMILES for methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium is C[Si](C)(C)c1ccccc1[P+](C)(c1ccccc1)c1ccccc1.
What is the InChIKey of methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium?
The InChIKey is CVGACNYCGDOKTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26PSi/c1-23(19-13-7-5-8-14-19,20-15-9-6-10-16-20)21-17-11-12-18-22(21)24(2,3)4/h5-18H,1-4H3/q+1.
What are the key properties of methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium?
methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium has a molecular weight of 349.51 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-diphenyl-(2-trimethylsilylphenyl)phosphanium is sourced from PubChem (CID 86241586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).