5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene

C11H22O3 — CID 118098316

IUPAC5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene
SMILESC=CCCCOCCOCCOCC
InChIInChI=1S/C11H22O3/c1-3-5-6-7-13-10-11-14-9-8-12-4-2/h3H,1,4-11H2,2H3
InChIKeyAFDCEHCUQKEOMW-UHFFFAOYSA-N
MW202.29 g/mol
LogP2.02
Rot. Bonds11

About 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene

5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene (PubChem CID 118098316) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene.

Molecular Properties

Compound Name5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene
PubChem CID118098316
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene
SMILESC=CCCCOCCOCCOCC
InChIInChI=1S/C11H22O3/c1-3-5-6-7-13-10-11-14-9-8-12-4-2/h3H,1,4-11H2,2H3
InChIKeyAFDCEHCUQKEOMW-UHFFFAOYSA-N
XLogP2.02
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene?
The IUPAC name of 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene (CID 118098316) is 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene.
What is the SMILES notation for 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene?
The canonical SMILES for 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene is C=CCCCOCCOCCOCC.
What is the InChIKey of 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene?
The InChIKey is AFDCEHCUQKEOMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3/c1-3-5-6-7-13-10-11-14-9-8-12-4-2/h3H,1,4-11H2,2H3.
What are the key properties of 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene?
5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene has a molecular weight of 202.29 g/mol, XLogP of 2.02, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-ethoxyethoxy)ethoxy]pent-1-ene is sourced from PubChem (CID 118098316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).