2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol

C11H24O4 — CID 23132047

IUPAC2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol
SMILESCCCC(C)OCCOCCOCCO
InChIInChI=1S/C11H24O4/c1-3-4-11(2)15-10-9-14-8-7-13-6-5-12/h11-12H,3-10H2,1-2H3
InChIKeyAYIVTHITSLAIOM-UHFFFAOYSA-N
MW220.31 g/mol
LogP1.22
Rot. Bonds11

About 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol

2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol (PubChem CID 23132047) has the molecular formula C11H24O4 and a molecular weight of 220.31 g/mol. Its IUPAC name is 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol
PubChem CID23132047
Molecular FormulaC11H24O4
Molecular Weight220.31 g/mol
Exact Mass220.17
IUPAC Name2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol
SMILESCCCC(C)OCCOCCOCCO
InChIInChI=1S/C11H24O4/c1-3-4-11(2)15-10-9-14-8-7-13-6-5-12/h11-12H,3-10H2,1-2H3
InChIKeyAYIVTHITSLAIOM-UHFFFAOYSA-N
XLogP1.22
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 51.22
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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Related Compounds

2-[(2S)-pentan-2-yl]oxyethanol
CID 89167429
2-(2-dodecan-2-yloxyethoxy)ethanol
CID 71420952
2-[2-(2-decan-2-yloxyethoxy)ethoxy]ethanol
CID 87813837
2-[2-[2-[2-(2-heptan-3-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
CID 172858925
2-[2-[2-[2-[2-(2-butan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol;sulfuric acid
CID 87748726
2-[2-[2-[2-[2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 19893141
2-[2-[2-[2-[2-(9-methyldecan-4-yloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 142651386
2-[2-[2-[2-[2-[2-(2-ethylpentoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 177306208
2-[2-[2-[2-(2-nonan-4-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
CID 172771806
2-[2-[2-(2-decan-3-yloxyethoxy)ethoxy]ethoxy]ethanol
CID 176652980
2-[2-(2-methylheptan-3-yloxy)ethoxy]ethanol
CID 139910427
butane-1,1-diol;2-(2-hydroxyethoxy)ethanol
CID 87212260

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol?
The IUPAC name of 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol (CID 23132047) is 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol?
The canonical SMILES for 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol is CCCC(C)OCCOCCOCCO.
What is the InChIKey of 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol?
The InChIKey is AYIVTHITSLAIOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4/c1-3-4-11(2)15-10-9-14-8-7-13-6-5-12/h11-12H,3-10H2,1-2H3.
What are the key properties of 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol?
2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol has a molecular weight of 220.31 g/mol, XLogP of 1.22, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol is sourced from PubChem (CID 23132047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).