diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol

C9H25NO5P+ — CID 157208856

IUPACdiethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol
SMILESCCO[P+](C)(O)OCC.OCCNCCO
InChIInChI=1S/C5H14O3P.C4H11NO2/c1-4-7-9(3,6)8-5-2;6-3-1-5-2-4-7/h6H,4-5H2,1-3H3;5-7H,1-4H2/q+1;
InChIKeyWQOAHZLZALRNCV-UHFFFAOYSA-N
MW258.27 g/mol
LogP0.00
Rot. Bonds8

About diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol

diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol (PubChem CID 157208856) has the molecular formula C9H25NO5P+ and a molecular weight of 258.27 g/mol. Its IUPAC name is diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol.

Molecular Properties

Compound Namediethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol
PubChem CID157208856
Molecular FormulaC9H25NO5P+
Molecular Weight258.27 g/mol
Exact Mass258.15
IUPAC Namediethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol
SMILESCCO[P+](C)(O)OCC.OCCNCCO
InChIInChI=1S/C5H14O3P.C4H11NO2/c1-4-7-9(3,6)8-5-2;6-3-1-5-2-4-7/h6H,4-5H2,1-3H3;5-7H,1-4H2/q+1;
InChIKeyWQOAHZLZALRNCV-UHFFFAOYSA-N
XLogP0.00
TPSA91.18 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 50.00
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-(2-hydroxyethylamino)ethanol;propane
CID 142274456
1-(2-hydroxyethylamino)propan-2-ol;propane
CID 145289862
tris(2-(2-aminoethylamino)ethanol);propan-2-ol;titanium
CID 76711756
2-(propylamino)ethanol;hydrobromide
CID 175488073
ethanamine;2-(2-hydroxyethylamino)ethanol;hydrofluoride
CID 175606240
2-[1-[(2-hydroxyethylamino)methoxy]propoxymethylamino]ethanol
CID 59986137
2-[2-[methyl(propan-2-yl)amino]ethylamino]ethanol
CID 62641213
1-(ethylamino)ethanol;2-(ethylamino)ethanol
CID 157298760
2-(ethylamino)ethanol
CID 170923531
cyclopropane;2-(2-hydroxyethylamino)ethanol;triethoxysilane
CID 173039620
diethoxy-hydroxy-methylphosphanium;trifluoromethanesulfonic acid
CID 174469995
ethane;2-[2-(ethylamino)ethylamino]ethanol
CID 156647808

Frequently Asked Questions

What is the IUPAC name of diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol?
The IUPAC name of diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol (CID 157208856) is diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol.
What is the SMILES notation for diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol?
The canonical SMILES for diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol is CCO[P+](C)(O)OCC.OCCNCCO.
What is the InChIKey of diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol?
The InChIKey is WQOAHZLZALRNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14O3P.C4H11NO2/c1-4-7-9(3,6)8-5-2;6-3-1-5-2-4-7/h6H,4-5H2,1-3H3;5-7H,1-4H2/q+1;.
What are the key properties of diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol?
diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol has a molecular weight of 258.27 g/mol, XLogP of 0.00, 8 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-hydroxy-methylphosphanium;2-(2-hydroxyethylamino)ethanol is sourced from PubChem (CID 157208856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).