sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride

C18H17NaO4P+ — CID 173372057

IUPACsodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride
SMILESCCO[P+](=O)Oc1ccc(-c2ccc3ccccc3c2)cc1O.[H-].[Na+]
InChIInChI=1S/C18H15O4P.Na.H/c1-2-21-23(20)22-18-10-9-16(12-17(18)19)15-8-7-13-5-3-4-6-14(13)11-15;;/h3-12H,2H2,1H3;;/q;+1;-1/p+1
InChIKeyQGXZERLZIALCAD-UHFFFAOYSA-O
MW351.29 g/mol
LogP2.40
Rot. Bonds5

About sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride

sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride (PubChem CID 173372057) has the molecular formula C18H17NaO4P+ and a molecular weight of 351.29 g/mol. Its IUPAC name is sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride.

Molecular Properties

Compound Namesodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride
PubChem CID173372057
Molecular FormulaC18H17NaO4P+
Molecular Weight351.29 g/mol
Exact Mass351.08
IUPAC Namesodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride
SMILESCCO[P+](=O)Oc1ccc(-c2ccc3ccccc3c2)cc1O.[H-].[Na+]
InChIInChI=1S/C18H15O4P.Na.H/c1-2-21-23(20)22-18-10-9-16(12-17(18)19)15-8-7-13-5-3-4-6-14(13)11-15;;/h3-12H,2H2,1H3;;/q;+1;-1/p+1
InChIKeyQGXZERLZIALCAD-UHFFFAOYSA-O
XLogP2.40
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.29
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-methoxy-5-naphthalen-2-ylphenol
CID 53220915
2-(3,4-dimethoxyphenyl)naphthalene
CID 10890732
2-hydroxy-4-naphthalen-2-ylbenzoic acid
CID 53226801
3-methoxy-5-naphthalen-2-ylphenol
CID 53220916
ethyl 2-methyl-5-naphthalen-2-yl-1H-pyrrole-3-carboxylate
CID 135022067
benzo[f]azulene
CID 13065869
ethyl 4-bromo-2-naphthalen-2-ylbenzoate
CID 121421560
2-naphthalen-2-ylphenanthrene
CID 90738367
7-ethoxy-1,2,8-trifluoro-3-naphthalen-2-ylbiphenylene
CID 134473369
hydroxy-naphthalen-2-yloxy-oxophosphanium
CID 13310565
3-methylperoxynaphthalen-2-ol
CID 88579478
bis(2-naphthalen-2-yl-2-oxoethoxy)-oxophosphanium
CID 174874865

Frequently Asked Questions

What is the IUPAC name of sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride?
The IUPAC name of sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride (CID 173372057) is sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride.
What is the SMILES notation for sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride?
The canonical SMILES for sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride is CCO[P+](=O)Oc1ccc(-c2ccc3ccccc3c2)cc1O.[H-].[Na+].
What is the InChIKey of sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride?
The InChIKey is QGXZERLZIALCAD-UHFFFAOYSA-O. The full InChI is InChI=1S/C18H15O4P.Na.H/c1-2-21-23(20)22-18-10-9-16(12-17(18)19)15-8-7-13-5-3-4-6-14(13)11-15;;/h3-12H,2H2,1H3;;/q;+1;-1/p+1.
What are the key properties of sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride?
sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride has a molecular weight of 351.29 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;ethoxy-(2-hydroxy-4-naphthalen-2-ylphenoxy)-oxophosphanium;hydride is sourced from PubChem (CID 173372057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).