2-hydroxyethyl-methoxy-oxophosphanium

C3H8O3P+ — CID 118907255

IUPAC2-hydroxyethyl-methoxy-oxophosphanium
SMILESCO[P+](=O)CCO
InChIInChI=1S/C3H8O3P/c1-6-7(5)3-2-4/h4H,2-3H2,1H3/q+1
InChIKeyYFXFTLWLEKLMNJ-UHFFFAOYSA-N
MW123.07 g/mol
LogP0.37
Rot. Bonds3

About 2-hydroxyethyl-methoxy-oxophosphanium

2-hydroxyethyl-methoxy-oxophosphanium (PubChem CID 118907255) has the molecular formula C3H8O3P+ and a molecular weight of 123.07 g/mol. Its IUPAC name is 2-hydroxyethyl-methoxy-oxophosphanium.

Molecular Properties

Compound Name2-hydroxyethyl-methoxy-oxophosphanium
PubChem CID118907255
Molecular FormulaC3H8O3P+
Molecular Weight123.07 g/mol
Exact Mass123.02
IUPAC Name2-hydroxyethyl-methoxy-oxophosphanium
SMILESCO[P+](=O)CCO
InChIInChI=1S/C3H8O3P/c1-6-7(5)3-2-4/h4H,2-3H2,1H3/q+1
InChIKeyYFXFTLWLEKLMNJ-UHFFFAOYSA-N
XLogP0.37
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.07
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl-methoxy-oxophosphanium?
The IUPAC name of 2-hydroxyethyl-methoxy-oxophosphanium (CID 118907255) is 2-hydroxyethyl-methoxy-oxophosphanium.
What is the SMILES notation for 2-hydroxyethyl-methoxy-oxophosphanium?
The canonical SMILES for 2-hydroxyethyl-methoxy-oxophosphanium is CO[P+](=O)CCO.
What is the InChIKey of 2-hydroxyethyl-methoxy-oxophosphanium?
The InChIKey is YFXFTLWLEKLMNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O3P/c1-6-7(5)3-2-4/h4H,2-3H2,1H3/q+1.
What are the key properties of 2-hydroxyethyl-methoxy-oxophosphanium?
2-hydroxyethyl-methoxy-oxophosphanium has a molecular weight of 123.07 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl-methoxy-oxophosphanium is sourced from PubChem (CID 118907255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).