[(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane

C12H26O4Si2 — CID 101032161

IUPAC[(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane
SMILESCO/C=C(/C=C(\OC)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C12H26O4Si2/c1-13-10-11(15-17(3,4)5)9-12(14-2)16-18(6,7)8/h9-10H,1-8H3/b11-10-,12-9+
InChIKeyUNPVSIWOVQLNBS-YPOAXGCUSA-N
MW290.51 g/mol
LogP3.66
Rot. Bonds7

About [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane

[(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane (PubChem CID 101032161) has the molecular formula C12H26O4Si2 and a molecular weight of 290.51 g/mol. Its IUPAC name is [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane.

Molecular Properties

Compound Name[(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane
PubChem CID101032161
Molecular FormulaC12H26O4Si2
Molecular Weight290.51 g/mol
Exact Mass290.14
IUPAC Name[(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane
SMILESCO/C=C(/C=C(\OC)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C12H26O4Si2/c1-13-10-11(15-17(3,4)5)9-12(14-2)16-18(6,7)8/h9-10H,1-8H3/b11-10-,12-9+
InChIKeyUNPVSIWOVQLNBS-YPOAXGCUSA-N
XLogP3.66
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.51
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane?
The IUPAC name of [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane (CID 101032161) is [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane.
What is the SMILES notation for [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane?
The canonical SMILES for [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane is CO/C=C(/C=C(\OC)O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane?
The InChIKey is UNPVSIWOVQLNBS-YPOAXGCUSA-N. The full InChI is InChI=1S/C12H26O4Si2/c1-13-10-11(15-17(3,4)5)9-12(14-2)16-18(6,7)8/h9-10H,1-8H3/b11-10-,12-9+.
What are the key properties of [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane?
[(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane has a molecular weight of 290.51 g/mol, XLogP of 3.66, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E,3Z)-1,4-dimethoxy-3-trimethylsilyloxybuta-1,3-dienoxy]-trimethylsilane is sourced from PubChem (CID 101032161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).