2-(diethoxyphosphorylmethoxy)ethanol

C7H17O5P — CID 10262588

IUPAC2-(diethoxyphosphorylmethoxy)ethanol
SMILESCCOP(=O)(COCCO)OCC
InChIInChI=1S/C7H17O5P/c1-3-11-13(9,12-4-2)7-10-6-5-8/h8H,3-7H2,1-2H3
InChIKeyATJHEGFVOKHRPN-UHFFFAOYSA-N
MW212.18 g/mol
LogP1.22
Rot. Bonds8

About 2-(diethoxyphosphorylmethoxy)ethanol

2-(diethoxyphosphorylmethoxy)ethanol (PubChem CID 10262588) has the molecular formula C7H17O5P and a molecular weight of 212.18 g/mol. Its IUPAC name is 2-(diethoxyphosphorylmethoxy)ethanol.

Molecular Properties

Compound Name2-(diethoxyphosphorylmethoxy)ethanol
PubChem CID10262588
Molecular FormulaC7H17O5P
Molecular Weight212.18 g/mol
Exact Mass212.08
IUPAC Name2-(diethoxyphosphorylmethoxy)ethanol
SMILESCCOP(=O)(COCCO)OCC
InChIInChI=1S/C7H17O5P/c1-3-11-13(9,12-4-2)7-10-6-5-8/h8H,3-7H2,1-2H3
InChIKeyATJHEGFVOKHRPN-UHFFFAOYSA-N
XLogP1.22
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.18
LogP ≤ 51.22
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-(diethoxyphosphorylmethoxy)ethanol?
The IUPAC name of 2-(diethoxyphosphorylmethoxy)ethanol (CID 10262588) is 2-(diethoxyphosphorylmethoxy)ethanol.
What is the SMILES notation for 2-(diethoxyphosphorylmethoxy)ethanol?
The canonical SMILES for 2-(diethoxyphosphorylmethoxy)ethanol is CCOP(=O)(COCCO)OCC.
What is the InChIKey of 2-(diethoxyphosphorylmethoxy)ethanol?
The InChIKey is ATJHEGFVOKHRPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17O5P/c1-3-11-13(9,12-4-2)7-10-6-5-8/h8H,3-7H2,1-2H3.
What are the key properties of 2-(diethoxyphosphorylmethoxy)ethanol?
2-(diethoxyphosphorylmethoxy)ethanol has a molecular weight of 212.18 g/mol, XLogP of 1.22, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethoxyphosphorylmethoxy)ethanol is sourced from PubChem (CID 10262588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).