ethoxy(2-hydroxyethyl)phosphinic acid

C4H11O4P — CID 87225689

IUPACethoxy(2-hydroxyethyl)phosphinic acid
SMILESCCOP(=O)(O)CCO
InChIInChI=1S/C4H11O4P/c1-2-8-9(6,7)4-3-5/h5H,2-4H2,1H3,(H,6,7)
InChIKeyBJWXRQUITKSDPA-UHFFFAOYSA-N
MW154.10 g/mol
LogP0.20
Rot. Bonds4

About ethoxy(2-hydroxyethyl)phosphinic acid

ethoxy(2-hydroxyethyl)phosphinic acid (PubChem CID 87225689) has the molecular formula C4H11O4P and a molecular weight of 154.10 g/mol. Its IUPAC name is ethoxy(2-hydroxyethyl)phosphinic acid.

Molecular Properties

Compound Nameethoxy(2-hydroxyethyl)phosphinic acid
PubChem CID87225689
Molecular FormulaC4H11O4P
Molecular Weight154.10 g/mol
Exact Mass154.04
IUPAC Nameethoxy(2-hydroxyethyl)phosphinic acid
SMILESCCOP(=O)(O)CCO
InChIInChI=1S/C4H11O4P/c1-2-8-9(6,7)4-3-5/h5H,2-4H2,1H3,(H,6,7)
InChIKeyBJWXRQUITKSDPA-UHFFFAOYSA-N
XLogP0.20
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.10
LogP ≤ 50.20
H-Bond Donors ≤ 52
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 ethoxy(2-hydroxyethyl)phosphinic acid?
The IUPAC name of ethoxy(2-hydroxyethyl)phosphinic acid (CID 87225689) is ethoxy(2-hydroxyethyl)phosphinic acid.
What is the SMILES notation for ethoxy(2-hydroxyethyl)phosphinic acid?
The canonical SMILES for ethoxy(2-hydroxyethyl)phosphinic acid is CCOP(=O)(O)CCO.
What is the InChIKey of ethoxy(2-hydroxyethyl)phosphinic acid?
The InChIKey is BJWXRQUITKSDPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11O4P/c1-2-8-9(6,7)4-3-5/h5H,2-4H2,1H3,(H,6,7).
What are the key properties of ethoxy(2-hydroxyethyl)phosphinic acid?
ethoxy(2-hydroxyethyl)phosphinic acid has a molecular weight of 154.10 g/mol, XLogP of 0.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy(2-hydroxyethyl)phosphinic acid is sourced from PubChem (CID 87225689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).