ethoxy(triphenyl)phosphanium;hydrochloride

C20H21ClOP+ — CID 175230805

IUPACethoxy(triphenyl)phosphanium;hydrochloride
SMILESCCO[P+](c1ccccc1)(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C20H20OP.ClH/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;1H/q+1;
InChIKeyLYXGJNXRSQUBSD-UHFFFAOYSA-N
MW343.81 g/mol
LogP4.35
Rot. Bonds5

About ethoxy(triphenyl)phosphanium;hydrochloride

ethoxy(triphenyl)phosphanium;hydrochloride (PubChem CID 175230805) has the molecular formula C20H21ClOP+ and a molecular weight of 343.81 g/mol. Its IUPAC name is ethoxy(triphenyl)phosphanium;hydrochloride.

Molecular Properties

Compound Nameethoxy(triphenyl)phosphanium;hydrochloride
PubChem CID175230805
Molecular FormulaC20H21ClOP+
Molecular Weight343.81 g/mol
Exact Mass343.10
IUPAC Nameethoxy(triphenyl)phosphanium;hydrochloride
SMILESCCO[P+](c1ccccc1)(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C20H20OP.ClH/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;1H/q+1;
InChIKeyLYXGJNXRSQUBSD-UHFFFAOYSA-N
XLogP4.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.81
LogP ≤ 54.35
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
CID 10092776
ethoxy(triphenyl)phosphanium chloride
CID 154791752
ethoxy-dihydroxy-phenylphosphanium
CID 56992947
2-triphenylphosphaniumyloxyethanethiolate
CID 134876851
methoxy(triphenyl)phosphanium;hydrobromide
CID 174550748
triphenyl(triphenylphosphaniumyloxy)phosphanium dibromide
CID 87509247
(1,2-diethoxy-2-oxoethyl)-triphenylphosphanium;hydrochloride
CID 126960654
methyl-phenyl-dipropoxyphosphanium
CID 69053143
triphenyl(propyl)phosphanium;hydrochloride
CID 118516578
5,5-diethoxypentyl(triphenyl)phosphanium
CID 156628237
butanoyloxy(triphenyl)phosphanium
CID 57167471
ethoxy-formyl-diphenylphosphanium;1,3,5-trimethylbenzene;hydrate
CID 174599308

Frequently Asked Questions

What is the IUPAC name of ethoxy(triphenyl)phosphanium;hydrochloride?
The IUPAC name of ethoxy(triphenyl)phosphanium;hydrochloride (CID 175230805) is ethoxy(triphenyl)phosphanium;hydrochloride.
What is the SMILES notation for ethoxy(triphenyl)phosphanium;hydrochloride?
The canonical SMILES for ethoxy(triphenyl)phosphanium;hydrochloride is CCO[P+](c1ccccc1)(c1ccccc1)c1ccccc1.Cl.
What is the InChIKey of ethoxy(triphenyl)phosphanium;hydrochloride?
The InChIKey is LYXGJNXRSQUBSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20OP.ClH/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;1H/q+1;.
What are the key properties of ethoxy(triphenyl)phosphanium;hydrochloride?
ethoxy(triphenyl)phosphanium;hydrochloride has a molecular weight of 343.81 g/mol, XLogP of 4.35, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy(triphenyl)phosphanium;hydrochloride is sourced from PubChem (CID 175230805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).