[(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane

C17H34O3Si2 — CID 11782848

IUPAC[(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane
SMILESC=C(O[Si](C)(C)C)C(/C=C/CCCC)=C(/OC)O[Si](C)(C)C
InChIInChI=1S/C17H34O3Si2/c1-10-11-12-13-14-16(15(2)19-21(4,5)6)17(18-3)20-22(7,8)9/h13-14H,2,10-12H2,1,3-9H3/b14-13+,17-16-
InChIKeyBCPXKROYFUNCBD-RBPKOWMCSA-N
MW342.63 g/mol
LogP5.81
Rot. Bonds10

About [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane

[(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane (PubChem CID 11782848) has the molecular formula C17H34O3Si2 and a molecular weight of 342.63 g/mol. Its IUPAC name is [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane.

Molecular Properties

Compound Name[(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane
PubChem CID11782848
Molecular FormulaC17H34O3Si2
Molecular Weight342.63 g/mol
Exact Mass342.20
IUPAC Name[(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane
SMILESC=C(O[Si](C)(C)C)C(/C=C/CCCC)=C(/OC)O[Si](C)(C)C
InChIInChI=1S/C17H34O3Si2/c1-10-11-12-13-14-16(15(2)19-21(4,5)6)17(18-3)20-22(7,8)9/h13-14H,2,10-12H2,1,3-9H3/b14-13+,17-16-
InChIKeyBCPXKROYFUNCBD-RBPKOWMCSA-N
XLogP5.81
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.63
LogP ≤ 55.81
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'}, {'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 [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane?
The IUPAC name of [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane (CID 11782848) is [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane.
What is the SMILES notation for [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane?
The canonical SMILES for [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane is C=C(O[Si](C)(C)C)C(/C=C/CCCC)=C(/OC)O[Si](C)(C)C.
What is the InChIKey of [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane?
The InChIKey is BCPXKROYFUNCBD-RBPKOWMCSA-N. The full InChI is InChI=1S/C17H34O3Si2/c1-10-11-12-13-14-16(15(2)19-21(4,5)6)17(18-3)20-22(7,8)9/h13-14H,2,10-12H2,1,3-9H3/b14-13+,17-16-.
What are the key properties of [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane?
[(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane has a molecular weight of 342.63 g/mol, XLogP of 5.81, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1Z,3E)-1-methoxy-2-(1-trimethylsilyloxyethenyl)octa-1,3-dienoxy]-trimethylsilane is sourced from PubChem (CID 11782848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).