2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene

C9H18O3 — CID 22491580

IUPAC2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene
SMILESC=C(C)OCCOCCOCC
InChIInChI=1S/C9H18O3/c1-4-10-5-6-11-7-8-12-9(2)3/h2,4-8H2,1,3H3
InChIKeyGJLNQYAXSGPKJF-UHFFFAOYSA-N
MW174.24 g/mol
LogP1.59
Rot. Bonds8

About 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene

2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene (PubChem CID 22491580) has the molecular formula C9H18O3 and a molecular weight of 174.24 g/mol. Its IUPAC name is 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene.

Molecular Properties

Compound Name2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene
PubChem CID22491580
Molecular FormulaC9H18O3
Molecular Weight174.24 g/mol
Exact Mass174.13
IUPAC Name2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene
SMILESC=C(C)OCCOCCOCC
InChIInChI=1S/C9H18O3/c1-4-10-5-6-11-7-8-12-9(2)3/h2,4-8H2,1,3H3
InChIKeyGJLNQYAXSGPKJF-UHFFFAOYSA-N
XLogP1.59
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene?
The IUPAC name of 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene (CID 22491580) is 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene.
What is the SMILES notation for 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene?
The canonical SMILES for 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene is C=C(C)OCCOCCOCC.
What is the InChIKey of 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene?
The InChIKey is GJLNQYAXSGPKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O3/c1-4-10-5-6-11-7-8-12-9(2)3/h2,4-8H2,1,3H3.
What are the key properties of 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene?
2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene has a molecular weight of 174.24 g/mol, XLogP of 1.59, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxyethoxy)ethoxy]prop-1-ene is sourced from PubChem (CID 22491580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).