[(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane

C9H18OSi — CID 15706654

IUPAC[(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane
SMILESC/C=C(/C=C/C)O[Si](C)(C)C
InChIInChI=1S/C9H18OSi/c1-6-8-9(7-2)10-11(3,4)5/h6-8H,1-5H3/b8-6+,9-7-
InChIKeyYJVFPQBZSGVHAE-FFELTBSMSA-N
MW170.33 g/mol
LogP3.32
Rot. Bonds3

About [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane

[(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane (PubChem CID 15706654) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane
PubChem CID15706654
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Name[(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane
SMILESC/C=C(/C=C/C)O[Si](C)(C)C
InChIInChI=1S/C9H18OSi/c1-6-8-9(7-2)10-11(3,4)5/h6-8H,1-5H3/b8-6+,9-7-
InChIKeyYJVFPQBZSGVHAE-FFELTBSMSA-N
XLogP3.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane?
The IUPAC name of [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane (CID 15706654) is [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane.
What is the SMILES notation for [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane?
The canonical SMILES for [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane is C/C=C(/C=C/C)O[Si](C)(C)C.
What is the InChIKey of [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane?
The InChIKey is YJVFPQBZSGVHAE-FFELTBSMSA-N. The full InChI is InChI=1S/C9H18OSi/c1-6-8-9(7-2)10-11(3,4)5/h6-8H,1-5H3/b8-6+,9-7-.
What are the key properties of [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane?
[(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane has a molecular weight of 170.33 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2Z,4E)-hexa-2,4-dien-3-yl]oxy-trimethylsilane is sourced from PubChem (CID 15706654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).