[ethenoxy(ethoxy)methoxy]ethane

C7H14O3 — CID 71311029

IUPAC[ethenoxy(ethoxy)methoxy]ethane
SMILESC=COC(OCC)OCC
InChIInChI=1S/C7H14O3/c1-4-8-7(9-5-2)10-6-3/h4,7H,1,5-6H2,2-3H3
InChIKeyAOYJISNQMSDAHR-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.50
Rot. Bonds6

About [ethenoxy(ethoxy)methoxy]ethane

[ethenoxy(ethoxy)methoxy]ethane (PubChem CID 71311029) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is [ethenoxy(ethoxy)methoxy]ethane.

Molecular Properties

Compound Name[ethenoxy(ethoxy)methoxy]ethane
PubChem CID71311029
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name[ethenoxy(ethoxy)methoxy]ethane
SMILESC=COC(OCC)OCC
InChIInChI=1S/C7H14O3/c1-4-8-7(9-5-2)10-6-3/h4,7H,1,5-6H2,2-3H3
InChIKeyAOYJISNQMSDAHR-UHFFFAOYSA-N
XLogP1.50
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze [ethenoxy(ethoxy)methoxy]ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [ethenoxy(ethoxy)methoxy]ethane?
The IUPAC name of [ethenoxy(ethoxy)methoxy]ethane (CID 71311029) is [ethenoxy(ethoxy)methoxy]ethane.
What is the SMILES notation for [ethenoxy(ethoxy)methoxy]ethane?
The canonical SMILES for [ethenoxy(ethoxy)methoxy]ethane is C=COC(OCC)OCC.
What is the InChIKey of [ethenoxy(ethoxy)methoxy]ethane?
The InChIKey is AOYJISNQMSDAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O3/c1-4-8-7(9-5-2)10-6-3/h4,7H,1,5-6H2,2-3H3.
What are the key properties of [ethenoxy(ethoxy)methoxy]ethane?
[ethenoxy(ethoxy)methoxy]ethane has a molecular weight of 146.19 g/mol, XLogP of 1.50, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [ethenoxy(ethoxy)methoxy]ethane is sourced from PubChem (CID 71311029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).