2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol

C24H48O6 — CID 11189685

IUPAC2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol
SMILESCCCCCCCCC1CCCCC1OCCOCCOCCOCCOCCO
InChIInChI=1S/C24H48O6/c1-2-3-4-5-6-7-10-23-11-8-9-12-24(23)30-22-21-29-20-19-28-18-17-27-16-15-26-14-13-25/h23-25H,2-22H2,1H3
InChIKeyNQANUUCYLKAPTL-UHFFFAOYSA-N
MW432.64 g/mol
LogP4.37
Rot. Bonds22

About 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol

2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol (PubChem CID 11189685) has the molecular formula C24H48O6 and a molecular weight of 432.64 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol
PubChem CID11189685
Molecular FormulaC24H48O6
Molecular Weight432.64 g/mol
Exact Mass432.35
IUPAC Name2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol
SMILESCCCCCCCCC1CCCCC1OCCOCCOCCOCCOCCO
InChIInChI=1S/C24H48O6/c1-2-3-4-5-6-7-10-23-11-8-9-12-24(23)30-22-21-29-20-19-28-18-17-27-16-15-26-14-13-25/h23-25H,2-22H2,1H3
InChIKeyNQANUUCYLKAPTL-UHFFFAOYSA-N
XLogP4.37
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds22
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.64
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol (CID 11189685) is 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol is CCCCCCCCC1CCCCC1OCCOCCOCCOCCOCCO.
What is the InChIKey of 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol?
The InChIKey is NQANUUCYLKAPTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H48O6/c1-2-3-4-5-6-7-10-23-11-8-9-12-24(23)30-22-21-29-20-19-28-18-17-27-16-15-26-14-13-25/h23-25H,2-22H2,1H3.
What are the key properties of 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol?
2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol has a molecular weight of 432.64 g/mol, XLogP of 4.37, 22 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[2-(2-octylcyclohexyl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 11189685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).