[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane

C11H22OSi — CID 11229389

IUPAC[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane
SMILESCC[C@@H]1C=C(O[Si](C)(C)C)CCC1
InChIInChI=1S/C11H22OSi/c1-5-10-7-6-8-11(9-10)12-13(2,3)4/h9-10H,5-8H2,1-4H3/t10-/m0/s1
InChIKeyUXPTUMMWCJHEPE-JTQLQIEISA-N
MW198.38 g/mol
LogP3.93
Rot. Bonds3

About [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane

[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane (PubChem CID 11229389) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane
PubChem CID11229389
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane
SMILESCC[C@@H]1C=C(O[Si](C)(C)C)CCC1
InChIInChI=1S/C11H22OSi/c1-5-10-7-6-8-11(9-10)12-13(2,3)4/h9-10H,5-8H2,1-4H3/t10-/m0/s1
InChIKeyUXPTUMMWCJHEPE-JTQLQIEISA-N
XLogP3.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane?
The IUPAC name of [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane (CID 11229389) is [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane.
What is the SMILES notation for [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane?
The canonical SMILES for [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane is CC[C@@H]1C=C(O[Si](C)(C)C)CCC1.
What is the InChIKey of [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane?
The InChIKey is UXPTUMMWCJHEPE-JTQLQIEISA-N. The full InChI is InChI=1S/C11H22OSi/c1-5-10-7-6-8-11(9-10)12-13(2,3)4/h9-10H,5-8H2,1-4H3/t10-/m0/s1.
What are the key properties of [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane?
[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane has a molecular weight of 198.38 g/mol, XLogP of 3.93, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane is sourced from PubChem (CID 11229389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).