1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane

C11H24O4 — CID 18344639

IUPAC1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane
SMILESCCCCOCCOCCOCCOC
InChIInChI=1S/C11H24O4/c1-3-4-5-13-8-9-15-11-10-14-7-6-12-2/h3-11H2,1-2H3
InChIKeySNAQINZKMQFYFV-UHFFFAOYSA-N
MW220.31 g/mol
LogP1.48
Rot. Bonds12

About 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane

1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane (PubChem CID 18344639) has the molecular formula C11H24O4 and a molecular weight of 220.31 g/mol. Its IUPAC name is 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane.

Molecular Properties

Compound Name1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane
PubChem CID18344639
Molecular FormulaC11H24O4
Molecular Weight220.31 g/mol
Exact Mass220.17
IUPAC Name1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane
SMILESCCCCOCCOCCOCCOC
InChIInChI=1S/C11H24O4/c1-3-4-5-13-8-9-15-11-10-14-7-6-12-2/h3-11H2,1-2H3
InChIKeySNAQINZKMQFYFV-UHFFFAOYSA-N
XLogP1.48
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane?
The IUPAC name of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane (CID 18344639) is 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane.
What is the SMILES notation for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane?
The canonical SMILES for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane is CCCCOCCOCCOCCOC.
What is the InChIKey of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane?
The InChIKey is SNAQINZKMQFYFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4/c1-3-4-5-13-8-9-15-11-10-14-7-6-12-2/h3-11H2,1-2H3.
What are the key properties of 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane?
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane has a molecular weight of 220.31 g/mol, XLogP of 1.48, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane is sourced from PubChem (CID 18344639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).