(E)-1,4-dimethoxy-2,3-dimethylbut-2-ene

C8H16O2 — CID 11744760

IUPAC(E)-1,4-dimethoxy-2,3-dimethylbut-2-ene
SMILESCOC/C(C)=C(\C)COC
InChIInChI=1S/C8H16O2/c1-7(5-9-3)8(2)6-10-4/h5-6H2,1-4H3/b8-7+
InChIKeyULUGTTQXMUMCEF-BQYQJAHWSA-N
MW144.21 g/mol
LogP1.62
Rot. Bonds4

About (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene

(E)-1,4-dimethoxy-2,3-dimethylbut-2-ene (PubChem CID 11744760) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene.

Molecular Properties

Compound Name(E)-1,4-dimethoxy-2,3-dimethylbut-2-ene
PubChem CID11744760
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(E)-1,4-dimethoxy-2,3-dimethylbut-2-ene
SMILESCOC/C(C)=C(\C)COC
InChIInChI=1S/C8H16O2/c1-7(5-9-3)8(2)6-10-4/h5-6H2,1-4H3/b8-7+
InChIKeyULUGTTQXMUMCEF-BQYQJAHWSA-N
XLogP1.62
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 ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene?
The IUPAC name of (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene (CID 11744760) is (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene.
What is the SMILES notation for (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene?
The canonical SMILES for (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene is COC/C(C)=C(\C)COC.
What is the InChIKey of (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene?
The InChIKey is ULUGTTQXMUMCEF-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H16O2/c1-7(5-9-3)8(2)6-10-4/h5-6H2,1-4H3/b8-7+.
What are the key properties of (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene?
(E)-1,4-dimethoxy-2,3-dimethylbut-2-ene has a molecular weight of 144.21 g/mol, XLogP of 1.62, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,4-dimethoxy-2,3-dimethylbut-2-ene is sourced from PubChem (CID 11744760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).