5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane

C16H34O3 — CID 150891032

IUPAC5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane
SMILESCCCCC(CCCC)CCOCCOCCOC
InChIInChI=1S/C16H34O3/c1-4-6-8-16(9-7-5-2)10-11-18-14-15-19-13-12-17-3/h16H,4-15H2,1-3H3
InChIKeyKYAKZXNCWPBABX-UHFFFAOYSA-N
MW274.44 g/mol
LogP4.05
Rot. Bonds15

About 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane

5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane (PubChem CID 150891032) has the molecular formula C16H34O3 and a molecular weight of 274.44 g/mol. Its IUPAC name is 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane.

Molecular Properties

Compound Name5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane
PubChem CID150891032
Molecular FormulaC16H34O3
Molecular Weight274.44 g/mol
Exact Mass274.25
IUPAC Name5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane
SMILESCCCCC(CCCC)CCOCCOCCOC
InChIInChI=1S/C16H34O3/c1-4-6-8-16(9-7-5-2)10-11-18-14-15-19-13-12-17-3/h16H,4-15H2,1-3H3
InChIKeyKYAKZXNCWPBABX-UHFFFAOYSA-N
XLogP4.05
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.44
LogP ≤ 54.05
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 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane?
The IUPAC name of 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane (CID 150891032) is 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane.
What is the SMILES notation for 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane?
The canonical SMILES for 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane is CCCCC(CCCC)CCOCCOCCOC.
What is the InChIKey of 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane?
The InChIKey is KYAKZXNCWPBABX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O3/c1-4-6-8-16(9-7-5-2)10-11-18-14-15-19-13-12-17-3/h16H,4-15H2,1-3H3.
What are the key properties of 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane?
5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane has a molecular weight of 274.44 g/mol, XLogP of 4.05, 15 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]nonane is sourced from PubChem (CID 150891032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).