2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene

C14H28O3 — CID 134290095

IUPAC2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene
SMILESC=C(OCCOCCOC)C(C)(C)C(C)(C)C
InChIInChI=1S/C14H28O3/c1-12(14(5,6)13(2,3)4)17-11-10-16-9-8-15-7/h1,8-11H2,2-7H3
InChIKeyXPRPPEJHIGLIJF-UHFFFAOYSA-N
MW244.37 g/mol
LogP3.25
Rot. Bonds8

About 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene

2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene (PubChem CID 134290095) has the molecular formula C14H28O3 and a molecular weight of 244.37 g/mol. Its IUPAC name is 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene.

Molecular Properties

Compound Name2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene
PubChem CID134290095
Molecular FormulaC14H28O3
Molecular Weight244.37 g/mol
Exact Mass244.20
IUPAC Name2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene
SMILESC=C(OCCOCCOC)C(C)(C)C(C)(C)C
InChIInChI=1S/C14H28O3/c1-12(14(5,6)13(2,3)4)17-11-10-16-9-8-15-7/h1,8-11H2,2-7H3
InChIKeyXPRPPEJHIGLIJF-UHFFFAOYSA-N
XLogP3.25
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.37
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene?
The IUPAC name of 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene (CID 134290095) is 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene.
What is the SMILES notation for 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene?
The canonical SMILES for 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene is C=C(OCCOCCOC)C(C)(C)C(C)(C)C.
What is the InChIKey of 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene?
The InChIKey is XPRPPEJHIGLIJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3/c1-12(14(5,6)13(2,3)4)17-11-10-16-9-8-15-7/h1,8-11H2,2-7H3.
What are the key properties of 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene?
2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene has a molecular weight of 244.37 g/mol, XLogP of 3.25, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethoxy)ethoxy]-3,3,4,4-tetramethylpent-1-ene is sourced from PubChem (CID 134290095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).