[(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane

C9H18O2Si — CID 14791516

IUPAC[(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane
SMILESC/C=C/C=C(\OC)O[Si](C)(C)C
InChIInChI=1S/C9H18O2Si/c1-6-7-8-9(10-2)11-12(3,4)5/h6-8H,1-5H3/b7-6+,9-8+
InChIKeyOXYSDXQYQQJGGI-BLHCBFLLSA-N
MW186.33 g/mol
LogP2.90
Rot. Bonds4

About [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane

[(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane (PubChem CID 14791516) has the molecular formula C9H18O2Si and a molecular weight of 186.33 g/mol. Its IUPAC name is [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane.

Molecular Properties

Compound Name[(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane
PubChem CID14791516
Molecular FormulaC9H18O2Si
Molecular Weight186.33 g/mol
Exact Mass186.11
IUPAC Name[(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane
SMILESC/C=C/C=C(\OC)O[Si](C)(C)C
InChIInChI=1S/C9H18O2Si/c1-6-7-8-9(10-2)11-12(3,4)5/h6-8H,1-5H3/b7-6+,9-8+
InChIKeyOXYSDXQYQQJGGI-BLHCBFLLSA-N
XLogP2.90
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.33
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane?
The IUPAC name of [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane (CID 14791516) is [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane.
What is the SMILES notation for [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane?
The canonical SMILES for [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane is C/C=C/C=C(\OC)O[Si](C)(C)C.
What is the InChIKey of [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane?
The InChIKey is OXYSDXQYQQJGGI-BLHCBFLLSA-N. The full InChI is InChI=1S/C9H18O2Si/c1-6-7-8-9(10-2)11-12(3,4)5/h6-8H,1-5H3/b7-6+,9-8+.
What are the key properties of [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane?
[(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane has a molecular weight of 186.33 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E,3E)-1-methoxypenta-1,3-dienoxy]-trimethylsilane is sourced from PubChem (CID 14791516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).