1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane

C18H36O4 — CID 151662960

IUPAC1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane
SMILESC=COCCOCCOCCOCCCCCCCCCC
InChIInChI=1S/C18H36O4/c1-3-5-6-7-8-9-10-11-12-20-15-16-22-18-17-21-14-13-19-4-2/h4H,2-3,5-18H2,1H3
InChIKeyQWXQDBJAEJCQTK-UHFFFAOYSA-N
MW316.48 g/mol
LogP4.34
Rot. Bonds19

About 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane

1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane (PubChem CID 151662960) has the molecular formula C18H36O4 and a molecular weight of 316.48 g/mol. Its IUPAC name is 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane.

Molecular Properties

Compound Name1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane
PubChem CID151662960
Molecular FormulaC18H36O4
Molecular Weight316.48 g/mol
Exact Mass316.26
IUPAC Name1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane
SMILESC=COCCOCCOCCOCCCCCCCCCC
InChIInChI=1S/C18H36O4/c1-3-5-6-7-8-9-10-11-12-20-15-16-22-18-17-21-14-13-19-4-2/h4H,2-3,5-18H2,1H3
InChIKeyQWXQDBJAEJCQTK-UHFFFAOYSA-N
XLogP4.34
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds19
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.48
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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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Related Compounds

1-(2-ethenoxyethoxy)dodecane
CID 59950400
1-ethenoxytriacontane
CID 14647805
1-(2-decoxyethoxy)decane
CID 14009354
1-[2-[2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]heptane
CID 150797704
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octadecane
CID 86345710
1-(2-octoxyethoxy)octane
CID 12711862
1-[2-[2-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 151767279
1-[2-(2-tetradecoxyethoxy)ethoxy]tetradecane
CID 10743953
1-[2-(2-heptoxyethoxy)ethoxy]heptane
CID 14402381
1-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]octane
CID 86197097
1-(2-nonoxyethoxy)nonane
CID 87982931
buta-1,3-diene;1-pentoxypentane
CID 87924219

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane?
The IUPAC name of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane (CID 151662960) is 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane.
What is the SMILES notation for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane?
The canonical SMILES for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane is C=COCCOCCOCCOCCCCCCCCCC.
What is the InChIKey of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane?
The InChIKey is QWXQDBJAEJCQTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36O4/c1-3-5-6-7-8-9-10-11-12-20-15-16-22-18-17-21-14-13-19-4-2/h4H,2-3,5-18H2,1H3.
What are the key properties of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane?
1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane has a molecular weight of 316.48 g/mol, XLogP of 4.34, 19 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]decane is sourced from PubChem (CID 151662960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).