2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium

C10H14O5P+ — CID 57208225

IUPAC2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium
SMILESO=[P+](OCCOCCO)Oc1ccccc1
InChIInChI=1S/C10H14O5P/c11-6-7-13-8-9-14-16(12)15-10-4-2-1-3-5-10/h1-5,11H,6-9H2/q+1
InChIKeyMZBRFJXROUZRGU-UHFFFAOYSA-N
MW245.19 g/mol
LogP1.75
Rot. Bonds8

About 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium

2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium (PubChem CID 57208225) has the molecular formula C10H14O5P+ and a molecular weight of 245.19 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium.

Molecular Properties

Compound Name2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium
PubChem CID57208225
Molecular FormulaC10H14O5P+
Molecular Weight245.19 g/mol
Exact Mass245.06
IUPAC Name2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium
SMILESO=[P+](OCCOCCO)Oc1ccccc1
InChIInChI=1S/C10H14O5P/c11-6-7-13-8-9-14-16(12)15-10-4-2-1-3-5-10/h1-5,11H,6-9H2/q+1
InChIKeyMZBRFJXROUZRGU-UHFFFAOYSA-N
XLogP1.75
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.19
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium?
The IUPAC name of 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium (CID 57208225) is 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium.
What is the SMILES notation for 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium?
The canonical SMILES for 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium is O=[P+](OCCOCCO)Oc1ccccc1.
What is the InChIKey of 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium?
The InChIKey is MZBRFJXROUZRGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O5P/c11-6-7-13-8-9-14-16(12)15-10-4-2-1-3-5-10/h1-5,11H,6-9H2/q+1.
What are the key properties of 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium?
2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium has a molecular weight of 245.19 g/mol, XLogP of 1.75, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)ethoxy-oxo-phenoxyphosphanium is sourced from PubChem (CID 57208225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).