oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium

C11H18O2PSi+ — CID 175349749

IUPACoxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium
SMILESC[Si](C)(C)CCc1ccc(O[PH+]=O)cc1
InChIInChI=1S/C11H18O2PSi/c1-15(2,3)9-8-10-4-6-11(7-5-10)13-14-12/h4-7,14H,8-9H2,1-3H3/q+1
InChIKeyGSBZDCHPBLPWRX-UHFFFAOYSA-N
MW241.32 g/mol
LogP3.89
Rot. Bonds5

About oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium

oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium (PubChem CID 175349749) has the molecular formula C11H18O2PSi+ and a molecular weight of 241.32 g/mol. Its IUPAC name is oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium.

Molecular Properties

Compound Nameoxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium
PubChem CID175349749
Molecular FormulaC11H18O2PSi+
Molecular Weight241.32 g/mol
Exact Mass241.08
IUPAC Nameoxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium
SMILESC[Si](C)(C)CCc1ccc(O[PH+]=O)cc1
InChIInChI=1S/C11H18O2PSi/c1-15(2,3)9-8-10-4-6-11(7-5-10)13-14-12/h4-7,14H,8-9H2,1-3H3/q+1
InChIKeyGSBZDCHPBLPWRX-UHFFFAOYSA-N
XLogP3.89
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4-octylphenoxy)-oxophosphanium
CID 123939155
4-(2-trimethylsilylethyl)aniline
CID 68551367
trimethoxy(2-phenylethyl)silane;trimethyl(2-phenylethyl)silane
CID 159040096
2-(4-trimethylsilyloxyphenyl)ethanol
CID 167738071
(4-butylphenyl) 4-(4-trimethylsilylbutyl)benzoate
CID 19972182
[4-[2-[[2-(4-methoxyphenyl)ethyl-dimethylsilyl]oxy-dimethylsilyl]ethyl]phenyl] acetate
CID 59772013
4-[2-[ethoxy(dimethyl)silyl]ethyl]phenol
CID 141255485
[4-[3-[[3-(4-cyanatophenyl)propyl-dimethylsilyl]oxy-dimethylsilyl]propyl]phenyl] cyanate
CID 102021528
2-[4-(butoxymethyl)phenyl]ethyl-[2-[4-(butoxymethyl)phenyl]ethyl-dimethylsilyl]oxy-dimethylsilane
CID 67801522
O-[[4-(2-trimethylsilylethoxy)phenyl]methyl] ethanethioate
CID 59806211
(4-methoxyphenyl)(113C)methyl-trimethylsilane
CID 101034579
N,N-dimethyl-3-(4-trimethylsilyloxyphenyl)propan-1-amine
CID 170865655

Frequently Asked Questions

What is the IUPAC name of oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium?
The IUPAC name of oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium (CID 175349749) is oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium.
What is the SMILES notation for oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium?
The canonical SMILES for oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium is C[Si](C)(C)CCc1ccc(O[PH+]=O)cc1.
What is the InChIKey of oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium?
The InChIKey is GSBZDCHPBLPWRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2PSi/c1-15(2,3)9-8-10-4-6-11(7-5-10)13-14-12/h4-7,14H,8-9H2,1-3H3/q+1.
What are the key properties of oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium?
oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium has a molecular weight of 241.32 g/mol, XLogP of 3.89, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxo-[4-(2-trimethylsilylethyl)phenoxy]phosphanium is sourced from PubChem (CID 175349749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).