ethoxy(triphenyl)phosphanium

C20H20OP+ — CID 10092776

IUPACethoxy(triphenyl)phosphanium
SMILESCCO[P+](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20OP/c1-2-21-22(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,2H2,1H3/q+1
InChIKeyBMIYLPZHMDXLHI-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.93
Rot. Bonds5

About ethoxy(triphenyl)phosphanium

ethoxy(triphenyl)phosphanium (PubChem CID 10092776) has the molecular formula C20H20OP+ and a molecular weight of 307.35 g/mol. Its IUPAC name is ethoxy(triphenyl)phosphanium.

Molecular Properties

Compound Nameethoxy(triphenyl)phosphanium
PubChem CID10092776
Molecular FormulaC20H20OP+
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Nameethoxy(triphenyl)phosphanium
SMILESCCO[P+](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20OP/c1-2-21-22(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,2H2,1H3/q+1
InChIKeyBMIYLPZHMDXLHI-UHFFFAOYSA-N
XLogP3.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethoxy(triphenyl)phosphanium chloride
CID 154791752
ethoxy(triphenyl)phosphanium;hydrochloride
CID 175230805
ethoxy-dihydroxy-phenylphosphanium
CID 56992947
2-triphenylphosphaniumyloxyethanethiolate
CID 134876851
methoxy(triphenyl)phosphanium;hydrobromide
CID 174550748
triphenyl(triphenylphosphaniumyloxy)phosphanium dibromide
CID 87509247
methyl-phenyl-dipropoxyphosphanium
CID 69053143
butanoyloxy(triphenyl)phosphanium
CID 57167471
5,5-diethoxypentyl(triphenyl)phosphanium
CID 156628237
ethoxy-formyl-diphenylphosphanium;1,3,5-trimethylbenzene;hydrate
CID 174599308
13,13-diethoxytridecyl(triphenyl)phosphanium
CID 156628251
2-methylbutanoyloxy(triphenyl)phosphanium
CID 174535437

Frequently Asked Questions

What is the IUPAC name of ethoxy(triphenyl)phosphanium?
The IUPAC name of ethoxy(triphenyl)phosphanium (CID 10092776) is ethoxy(triphenyl)phosphanium.
What is the SMILES notation for ethoxy(triphenyl)phosphanium?
The canonical SMILES for ethoxy(triphenyl)phosphanium is CCO[P+](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of ethoxy(triphenyl)phosphanium?
The InChIKey is BMIYLPZHMDXLHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20OP/c1-2-21-22(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,2H2,1H3/q+1.
What are the key properties of ethoxy(triphenyl)phosphanium?
ethoxy(triphenyl)phosphanium has a molecular weight of 307.35 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy(triphenyl)phosphanium is sourced from PubChem (CID 10092776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).