2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol

C6H13O6P — CID 90819141

IUPAC2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol
SMILESO=P1(OCCOCCO)OCCO1
InChIInChI=1S/C6H13O6P/c7-1-2-9-3-4-10-13(8)11-5-6-12-13/h7H,1-6H2
InChIKeyRICOHFIGTUHODJ-UHFFFAOYSA-N
MW212.14 g/mol
LogP0.17
Rot. Bonds6

About 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol

2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol (PubChem CID 90819141) has the molecular formula C6H13O6P and a molecular weight of 212.14 g/mol. Its IUPAC name is 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol
PubChem CID90819141
Molecular FormulaC6H13O6P
Molecular Weight212.14 g/mol
Exact Mass212.04
IUPAC Name2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol
SMILESO=P1(OCCOCCO)OCCO1
InChIInChI=1S/C6H13O6P/c7-1-2-9-3-4-10-13(8)11-5-6-12-13/h7H,1-6H2
InChIKeyRICOHFIGTUHODJ-UHFFFAOYSA-N
XLogP0.17
TPSA74.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.14
LogP ≤ 50.17
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol (CID 90819141) is 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol is O=P1(OCCOCCO)OCCO1.
What is the InChIKey of 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol?
The InChIKey is RICOHFIGTUHODJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13O6P/c7-1-2-9-3-4-10-13(8)11-5-6-12-13/h7H,1-6H2.
What are the key properties of 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol?
2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol has a molecular weight of 212.14 g/mol, XLogP of 0.17, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-oxo-1,3,2λ5-dioxaphospholan-2-yl)oxy]ethoxy]ethanol is sourced from PubChem (CID 90819141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).