ethenyl-ethyl-diphenylphosphanium

C16H18P+ — CID 175448312

IUPACethenyl-ethyl-diphenylphosphanium
SMILESC=C[P+](CC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18P/c1-3-17(4-2,15-11-7-5-8-12-15)16-13-9-6-10-14-16/h3,5-14H,1,4H2,2H3/q+1
InChIKeyXFDGNGKNZOEHNO-UHFFFAOYSA-N
MW241.29 g/mol
LogP3.82
Rot. Bonds4

About ethenyl-ethyl-diphenylphosphanium

ethenyl-ethyl-diphenylphosphanium (PubChem CID 175448312) has the molecular formula C16H18P+ and a molecular weight of 241.29 g/mol. Its IUPAC name is ethenyl-ethyl-diphenylphosphanium.

Molecular Properties

Compound Nameethenyl-ethyl-diphenylphosphanium
PubChem CID175448312
Molecular FormulaC16H18P+
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Nameethenyl-ethyl-diphenylphosphanium
SMILESC=C[P+](CC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H18P/c1-3-17(4-2,15-11-7-5-8-12-15)16-13-9-6-10-14-16/h3,5-14H,1,4H2,2H3/q+1
InChIKeyXFDGNGKNZOEHNO-UHFFFAOYSA-N
XLogP3.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

chloro-ethyl-diphenylphosphanium
CID 15830242
diethyl(diphenyl)phosphanium hydroxide
CID 18407746
triethyl(phenyl)phosphanium chloride
CID 21464749
ethyl(triphenyl)phosphanium;hexahydrofluoride
CID 174986237
[(2S)-2-methylbut-3-enyl]-triphenylphosphanium
CID 10904649
ethyl(triphenyl)phosphanium;trifluorocopper(1-)
CID 19429065
CID 172998208
CID 172998208
tris(ethyl(triphenyl)phosphanium);phosphite
CID 157236342
1-bromopropyl(triphenyl)phosphanium
CID 22011137
[(2S)-butan-2-yl]-triphenylphosphanium
CID 98044399
azane;ethyl(triphenyl)phosphanium;iodide;hydroiodide
CID 174751810
methyl-phenyl-dipropylphosphanium
CID 70584071

Frequently Asked Questions

What is the IUPAC name of ethenyl-ethyl-diphenylphosphanium?
The IUPAC name of ethenyl-ethyl-diphenylphosphanium (CID 175448312) is ethenyl-ethyl-diphenylphosphanium.
What is the SMILES notation for ethenyl-ethyl-diphenylphosphanium?
The canonical SMILES for ethenyl-ethyl-diphenylphosphanium is C=C[P+](CC)(c1ccccc1)c1ccccc1.
What is the InChIKey of ethenyl-ethyl-diphenylphosphanium?
The InChIKey is XFDGNGKNZOEHNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18P/c1-3-17(4-2,15-11-7-5-8-12-15)16-13-9-6-10-14-16/h3,5-14H,1,4H2,2H3/q+1.
What are the key properties of ethenyl-ethyl-diphenylphosphanium?
ethenyl-ethyl-diphenylphosphanium has a molecular weight of 241.29 g/mol, XLogP of 3.82, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-ethyl-diphenylphosphanium is sourced from PubChem (CID 175448312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).