1-(2-ethoxyethoxy)-2-methoxyethane

C7H16O3 — CID 13847

IUPAC1-(2-ethoxyethoxy)-2-methoxyethane
SMILESCCOCCOCCOC
InChIInChI=1S/C7H16O3/c1-3-9-6-7-10-5-4-8-2/h3-7H2,1-2H3
InChIKeyCNJRPYFBORAQAU-UHFFFAOYSA-N
MW148.20 g/mol
LogP0.69
Rot. Bonds7

About 1-(2-ethoxyethoxy)-2-methoxyethane

1-(2-ethoxyethoxy)-2-methoxyethane (PubChem CID 13847) has the molecular formula C7H16O3 and a molecular weight of 148.20 g/mol. Its IUPAC name is 1-(2-ethoxyethoxy)-2-methoxyethane.

Molecular Properties

Compound Name1-(2-ethoxyethoxy)-2-methoxyethane
PubChem CID13847
Molecular FormulaC7H16O3
Molecular Weight148.20 g/mol
Exact Mass148.11
IUPAC Name1-(2-ethoxyethoxy)-2-methoxyethane
SMILESCCOCCOCCOC
InChIInChI=1S/C7H16O3/c1-3-9-6-7-10-5-4-8-2/h3-7H2,1-2H3
InChIKeyCNJRPYFBORAQAU-UHFFFAOYSA-N
XLogP0.69
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 50.69
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 1-(2-ethoxyethoxy)-2-methoxyethane?
The IUPAC name of 1-(2-ethoxyethoxy)-2-methoxyethane (CID 13847) is 1-(2-ethoxyethoxy)-2-methoxyethane.
What is the SMILES notation for 1-(2-ethoxyethoxy)-2-methoxyethane?
The canonical SMILES for 1-(2-ethoxyethoxy)-2-methoxyethane is CCOCCOCCOC.
What is the InChIKey of 1-(2-ethoxyethoxy)-2-methoxyethane?
The InChIKey is CNJRPYFBORAQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O3/c1-3-9-6-7-10-5-4-8-2/h3-7H2,1-2H3.
What are the key properties of 1-(2-ethoxyethoxy)-2-methoxyethane?
1-(2-ethoxyethoxy)-2-methoxyethane has a molecular weight of 148.20 g/mol, XLogP of 0.69, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethoxy)-2-methoxyethane is sourced from PubChem (CID 13847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).