2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane

C14H28O6 — CID 15721732

IUPAC2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane
SMILESCOCCOCC1(C)COCCOCCOCCCO1
InChIInChI=1S/C14H28O6/c1-14(12-18-7-6-15-2)13-19-11-10-17-9-8-16-4-3-5-20-14/h3-13H2,1-2H3
InChIKeyUCKKPZADICTTPD-UHFFFAOYSA-N
MW292.37 g/mol
LogP0.88
Rot. Bonds5

About 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane

2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane (PubChem CID 15721732) has the molecular formula C14H28O6 and a molecular weight of 292.37 g/mol. Its IUPAC name is 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane.

Molecular Properties

Compound Name2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane
PubChem CID15721732
Molecular FormulaC14H28O6
Molecular Weight292.37 g/mol
Exact Mass292.19
IUPAC Name2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane
SMILESCOCCOCC1(C)COCCOCCOCCCO1
InChIInChI=1S/C14H28O6/c1-14(12-18-7-6-15-2)13-19-11-10-17-9-8-16-4-3-5-20-14/h3-13H2,1-2H3
InChIKeyUCKKPZADICTTPD-UHFFFAOYSA-N
XLogP0.88
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

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CID 24838540
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Ethylene glycol bis(2,3-epoxy-2-methylpropyl) ether
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2-[2-(2-Methoxyethoxy)ethoxy]-2-methylpropane
CID 104324
Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-
CID 104323
Butane, 1-[2-(1,1-dimethylethoxy)ethoxy]-
CID 109580
2,2'-(Ethylenebis(oxy))bis(2-methylpropane)
CID 168554
3,6,9-Trimethyl-2,5,8,11-tetraoxadodecane
CID 15930777
Propane, 2,2'-[oxybis[(methyl-2,1-ethanediyl)oxy]]bis[2-methyl-
CID 21960672
Propylene glycol di-tert-butyl ether
CID 5362586
18-Methyl-2,5,8,11,14,17-hexaoxanonadecane
CID 6454511

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane?
The IUPAC name of 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane (CID 15721732) is 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane.
What is the SMILES notation for 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane?
The canonical SMILES for 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane is COCCOCC1(C)COCCOCCOCCCO1.
What is the InChIKey of 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane?
The InChIKey is UCKKPZADICTTPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O6/c1-14(12-18-7-6-15-2)13-19-11-10-17-9-8-16-4-3-5-20-14/h3-13H2,1-2H3.
What are the key properties of 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane?
2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane has a molecular weight of 292.37 g/mol, XLogP of 0.88, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxymethyl)-2-methyl-1,4,7,10-tetraoxacyclotridecane is sourced from PubChem (CID 15721732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).