2-(2-methoxyethoxy)-3-methylbut-2-ene

C8H16O2 — CID 520971

IUPAC2-(2-methoxyethoxy)-3-methylbut-2-ene
SMILESCOCCOC(C)=C(C)C
InChIInChI=1S/C8H16O2/c1-7(2)8(3)10-6-5-9-4/h5-6H2,1-4H3
InChIKeyZBWBYVIFNVMULT-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.96
Rot. Bonds4

About 2-(2-methoxyethoxy)-3-methylbut-2-ene

2-(2-methoxyethoxy)-3-methylbut-2-ene (PubChem CID 520971) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-3-methylbut-2-ene.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-3-methylbut-2-ene
PubChem CID520971
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name2-(2-methoxyethoxy)-3-methylbut-2-ene
SMILESCOCCOC(C)=C(C)C
InChIInChI=1S/C8H16O2/c1-7(2)8(3)10-6-5-9-4/h5-6H2,1-4H3
InChIKeyZBWBYVIFNVMULT-UHFFFAOYSA-N
XLogP1.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-methoxyethoxy)-3-methylbut-2-ene?
The IUPAC name of 2-(2-methoxyethoxy)-3-methylbut-2-ene (CID 520971) is 2-(2-methoxyethoxy)-3-methylbut-2-ene.
What is the SMILES notation for 2-(2-methoxyethoxy)-3-methylbut-2-ene?
The canonical SMILES for 2-(2-methoxyethoxy)-3-methylbut-2-ene is COCCOC(C)=C(C)C.
What is the InChIKey of 2-(2-methoxyethoxy)-3-methylbut-2-ene?
The InChIKey is ZBWBYVIFNVMULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-7(2)8(3)10-6-5-9-4/h5-6H2,1-4H3.
What are the key properties of 2-(2-methoxyethoxy)-3-methylbut-2-ene?
2-(2-methoxyethoxy)-3-methylbut-2-ene has a molecular weight of 144.21 g/mol, XLogP of 1.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-3-methylbut-2-ene is sourced from PubChem (CID 520971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).