1-(2-ethoxyethoxy)pentane

C9H20O2 — CID 18999776

IUPAC1-(2-ethoxyethoxy)pentane
SMILESCCCCCOCCOCC
InChIInChI=1S/C9H20O2/c1-3-5-6-7-11-9-8-10-4-2/h3-9H2,1-2H3
InChIKeyUOECJVYWINLCEV-UHFFFAOYSA-N
MW160.26 g/mol
LogP2.23
Rot. Bonds8

About 1-(2-ethoxyethoxy)pentane

1-(2-ethoxyethoxy)pentane (PubChem CID 18999776) has the molecular formula C9H20O2 and a molecular weight of 160.26 g/mol. Its IUPAC name is 1-(2-ethoxyethoxy)pentane.

Molecular Properties

Compound Name1-(2-ethoxyethoxy)pentane
PubChem CID18999776
Molecular FormulaC9H20O2
Molecular Weight160.26 g/mol
Exact Mass160.15
IUPAC Name1-(2-ethoxyethoxy)pentane
SMILESCCCCCOCCOCC
InChIInChI=1S/C9H20O2/c1-3-5-6-7-11-9-8-10-4-2/h3-9H2,1-2H3
InChIKeyUOECJVYWINLCEV-UHFFFAOYSA-N
XLogP2.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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)pentane?
The IUPAC name of 1-(2-ethoxyethoxy)pentane (CID 18999776) is 1-(2-ethoxyethoxy)pentane.
What is the SMILES notation for 1-(2-ethoxyethoxy)pentane?
The canonical SMILES for 1-(2-ethoxyethoxy)pentane is CCCCCOCCOCC.
What is the InChIKey of 1-(2-ethoxyethoxy)pentane?
The InChIKey is UOECJVYWINLCEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2/c1-3-5-6-7-11-9-8-10-4-2/h3-9H2,1-2H3.
What are the key properties of 1-(2-ethoxyethoxy)pentane?
1-(2-ethoxyethoxy)pentane has a molecular weight of 160.26 g/mol, XLogP of 2.23, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethoxy)pentane is sourced from PubChem (CID 18999776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).