2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane

C12H26O4 — CID 89483999

IUPAC2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane
SMILESCCC(C)(C)OCCOCCOCCOC
InChIInChI=1S/C12H26O4/c1-5-12(2,3)16-11-10-15-9-8-14-7-6-13-4/h5-11H2,1-4H3
InChIKeyMGDGLDHIDOURIS-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.87
Rot. Bonds11

About 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane

2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane (PubChem CID 89483999) has the molecular formula C12H26O4 and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane.

Molecular Properties

Compound Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane
PubChem CID89483999
Molecular FormulaC12H26O4
Molecular Weight234.34 g/mol
Exact Mass234.18
IUPAC Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane
SMILESCCC(C)(C)OCCOCCOCCOC
InChIInChI=1S/C12H26O4/c1-5-12(2,3)16-11-10-15-9-8-14-7-6-13-4/h5-11H2,1-4H3
InChIKeyMGDGLDHIDOURIS-UHFFFAOYSA-N
XLogP1.87
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane?
The IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane (CID 89483999) is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane.
What is the SMILES notation for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane?
The canonical SMILES for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane is CCC(C)(C)OCCOCCOCCOC.
What is the InChIKey of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane?
The InChIKey is MGDGLDHIDOURIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O4/c1-5-12(2,3)16-11-10-15-9-8-14-7-6-13-4/h5-11H2,1-4H3.
What are the key properties of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane?
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane has a molecular weight of 234.34 g/mol, XLogP of 1.87, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylbutane is sourced from PubChem (CID 89483999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).