2-[2-(2-propoxyethoxy)ethoxy]ethanol

C9H20O4 — CID 11355992

IUPAC2-[2-(2-propoxyethoxy)ethoxy]ethanol
SMILESCCCOCCOCCOCCO
InChIInChI=1S/C9H20O4/c1-2-4-11-6-8-13-9-7-12-5-3-10/h10H,2-9H2,1H3
InChIKeyKCBPVRDDYVJQHA-UHFFFAOYSA-N
MW192.25 g/mol
LogP0.44
Rot. Bonds10

About 2-[2-(2-propoxyethoxy)ethoxy]ethanol

2-[2-(2-propoxyethoxy)ethoxy]ethanol (PubChem CID 11355992) has the molecular formula C9H20O4 and a molecular weight of 192.25 g/mol. Its IUPAC name is 2-[2-(2-propoxyethoxy)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-propoxyethoxy)ethoxy]ethanol
PubChem CID11355992
Molecular FormulaC9H20O4
Molecular Weight192.25 g/mol
Exact Mass192.14
IUPAC Name2-[2-(2-propoxyethoxy)ethoxy]ethanol
SMILESCCCOCCOCCOCCO
InChIInChI=1S/C9H20O4/c1-2-4-11-6-8-13-9-7-12-5-3-10/h10H,2-9H2,1H3
InChIKeyKCBPVRDDYVJQHA-UHFFFAOYSA-N
XLogP0.44
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.25
LogP ≤ 50.44
H-Bond Donors ≤ 51
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 2-[2-(2-propoxyethoxy)ethoxy]ethanol?
The IUPAC name of 2-[2-(2-propoxyethoxy)ethoxy]ethanol (CID 11355992) is 2-[2-(2-propoxyethoxy)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(2-propoxyethoxy)ethoxy]ethanol?
The canonical SMILES for 2-[2-(2-propoxyethoxy)ethoxy]ethanol is CCCOCCOCCOCCO.
What is the InChIKey of 2-[2-(2-propoxyethoxy)ethoxy]ethanol?
The InChIKey is KCBPVRDDYVJQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O4/c1-2-4-11-6-8-13-9-7-12-5-3-10/h10H,2-9H2,1H3.
What are the key properties of 2-[2-(2-propoxyethoxy)ethoxy]ethanol?
2-[2-(2-propoxyethoxy)ethoxy]ethanol has a molecular weight of 192.25 g/mol, XLogP of 0.44, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-propoxyethoxy)ethoxy]ethanol is sourced from PubChem (CID 11355992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).