[(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane

C13H26OSi — CID 11964170

IUPAC[(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane
SMILESC/C(=C\CO[Si](C)(C)C)C1CCCCC1
InChIInChI=1S/C13H26OSi/c1-12(10-11-14-15(2,3)4)13-8-6-5-7-9-13/h10,13H,5-9,11H2,1-4H3/b12-10+
InChIKeyFFCHNOJOJJVIFX-ZRDIBKRKSA-N
MW226.44 g/mol
LogP4.36
Rot. Bonds4

About [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane

[(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane (PubChem CID 11964170) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane.

Molecular Properties

Compound Name[(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane
PubChem CID11964170
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Name[(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane
SMILESC/C(=C\CO[Si](C)(C)C)C1CCCCC1
InChIInChI=1S/C13H26OSi/c1-12(10-11-14-15(2,3)4)13-8-6-5-7-9-13/h10,13H,5-9,11H2,1-4H3/b12-10+
InChIKeyFFCHNOJOJJVIFX-ZRDIBKRKSA-N
XLogP4.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane?
The IUPAC name of [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane (CID 11964170) is [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane.
What is the SMILES notation for [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane?
The canonical SMILES for [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane is C/C(=C\CO[Si](C)(C)C)C1CCCCC1.
What is the InChIKey of [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane?
The InChIKey is FFCHNOJOJJVIFX-ZRDIBKRKSA-N. The full InChI is InChI=1S/C13H26OSi/c1-12(10-11-14-15(2,3)4)13-8-6-5-7-9-13/h10,13H,5-9,11H2,1-4H3/b12-10+.
What are the key properties of [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane?
[(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane has a molecular weight of 226.44 g/mol, XLogP of 4.36, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane is sourced from PubChem (CID 11964170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).