2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol

C13H28O5 — CID 139963056

IUPAC2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol
SMILESCC(C)C(C)OCCOCCOCCOCCO
InChIInChI=1S/C13H28O5/c1-12(2)13(3)18-11-10-17-9-8-16-7-6-15-5-4-14/h12-14H,4-11H2,1-3H3
InChIKeyRZCZELSDSDAWGE-UHFFFAOYSA-N
MW264.36 g/mol
LogP1.09
Rot. Bonds13

About 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol

2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol (PubChem CID 139963056) has the molecular formula C13H28O5 and a molecular weight of 264.36 g/mol. Its IUPAC name is 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol
PubChem CID139963056
Molecular FormulaC13H28O5
Molecular Weight264.36 g/mol
Exact Mass264.19
IUPAC Name2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol
SMILESCC(C)C(C)OCCOCCOCCOCCO
InChIInChI=1S/C13H28O5/c1-12(2)13(3)18-11-10-17-9-8-16-7-6-15-5-4-14/h12-14H,4-11H2,1-3H3
InChIKeyRZCZELSDSDAWGE-UHFFFAOYSA-N
XLogP1.09
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.36
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanol
CID 87592876
2-[2-[2-[2-[2-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 19893141
2-[2-(3-methylbutan-2-yloxy)ethoxy]ethanamine
CID 103482563
2-[2-(1-iodoethoxy)ethoxy]ethanol
CID 87184829
3-(3-methylbutan-2-yloxy)propan-1-ol
CID 58556710
2-[3-(2-hydroxyethoxy)butan-2-yloxy]ethanol
CID 14291300
ethane;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol
CID 159638520
2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 17472
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619695
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619703
5-(3-methylbutan-2-yloxy)pentan-1-ol
CID 58556716
2-[2-(2-pentan-2-yloxyethoxy)ethoxy]ethanol
CID 23132047

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol (CID 139963056) is 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol is CC(C)C(C)OCCOCCOCCOCCO.
What is the InChIKey of 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol?
The InChIKey is RZCZELSDSDAWGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O5/c1-12(2)13(3)18-11-10-17-9-8-16-7-6-15-5-4-14/h12-14H,4-11H2,1-3H3.
What are the key properties of 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol?
2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol has a molecular weight of 264.36 g/mol, XLogP of 1.09, 13 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(3-methylbutan-2-yloxy)ethoxy]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 139963056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).