1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane

C7H15IO3 — CID 10636020

IUPAC1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane
SMILESCOCCOCCOCCI
InChIInChI=1S/C7H15IO3/c1-9-4-5-11-7-6-10-3-2-8/h2-7H2,1H3
InChIKeyDLGFZOSPWIUMKY-UHFFFAOYSA-N
MW274.10 g/mol
LogP1.10
Rot. Bonds8

About 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane

1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane (PubChem CID 10636020) has the molecular formula C7H15IO3 and a molecular weight of 274.10 g/mol. Its IUPAC name is 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane.

Molecular Properties

Compound Name1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane
PubChem CID10636020
Molecular FormulaC7H15IO3
Molecular Weight274.10 g/mol
Exact Mass274.01
IUPAC Name1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane
SMILESCOCCOCCOCCI
InChIInChI=1S/C7H15IO3/c1-9-4-5-11-7-6-10-3-2-8/h2-7H2,1H3
InChIKeyDLGFZOSPWIUMKY-UHFFFAOYSA-N
XLogP1.10
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.10
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane?
The IUPAC name of 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane (CID 10636020) is 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane.
What is the SMILES notation for 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane?
The canonical SMILES for 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane is COCCOCCOCCI.
What is the InChIKey of 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane?
The InChIKey is DLGFZOSPWIUMKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15IO3/c1-9-4-5-11-7-6-10-3-2-8/h2-7H2,1H3.
What are the key properties of 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane?
1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane has a molecular weight of 274.10 g/mol, XLogP of 1.10, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-iodoethoxy)ethoxy]-2-methoxyethane is sourced from PubChem (CID 10636020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).