2-(2-methoxyethoxymethyl)oxetane

C7H14O3 — CID 58453080

IUPAC2-(2-methoxyethoxymethyl)oxetane
SMILESCOCCOCC1CCO1
InChIInChI=1S/C7H14O3/c1-8-4-5-9-6-7-2-3-10-7/h7H,2-6H2,1H3
InChIKeyISEJGVUSLPJFHO-UHFFFAOYSA-N
MW146.19 g/mol
LogP0.44
Rot. Bonds5

About 2-(2-methoxyethoxymethyl)oxetane

2-(2-methoxyethoxymethyl)oxetane (PubChem CID 58453080) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2-(2-methoxyethoxymethyl)oxetane.

Molecular Properties

Compound Name2-(2-methoxyethoxymethyl)oxetane
PubChem CID58453080
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name2-(2-methoxyethoxymethyl)oxetane
SMILESCOCCOCC1CCO1
InChIInChI=1S/C7H14O3/c1-8-4-5-9-6-7-2-3-10-7/h7H,2-6H2,1H3
InChIKeyISEJGVUSLPJFHO-UHFFFAOYSA-N
XLogP0.44
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxymethyl)oxetane?
The IUPAC name of 2-(2-methoxyethoxymethyl)oxetane (CID 58453080) is 2-(2-methoxyethoxymethyl)oxetane.
What is the SMILES notation for 2-(2-methoxyethoxymethyl)oxetane?
The canonical SMILES for 2-(2-methoxyethoxymethyl)oxetane is COCCOCC1CCO1.
What is the InChIKey of 2-(2-methoxyethoxymethyl)oxetane?
The InChIKey is ISEJGVUSLPJFHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O3/c1-8-4-5-9-6-7-2-3-10-7/h7H,2-6H2,1H3.
What are the key properties of 2-(2-methoxyethoxymethyl)oxetane?
2-(2-methoxyethoxymethyl)oxetane has a molecular weight of 146.19 g/mol, XLogP of 0.44, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxymethyl)oxetane is sourced from PubChem (CID 58453080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).