(1-ethynylcyclohexyl)oxy-trimethylsilane

C11H20OSi — CID 552482

IUPAC(1-ethynylcyclohexyl)oxy-trimethylsilane
SMILESC#CC1(O[Si](C)(C)C)CCCCC1
InChIInChI=1S/C11H20OSi/c1-5-11(12-13(2,3)4)9-7-6-8-10-11/h1H,6-10H2,2-4H3
InChIKeyKJDMMCYMVUTZSN-UHFFFAOYSA-N
MW196.37 g/mol
LogP3.17
Rot. Bonds2

About (1-ethynylcyclohexyl)oxy-trimethylsilane

(1-ethynylcyclohexyl)oxy-trimethylsilane (PubChem CID 552482) has the molecular formula C11H20OSi and a molecular weight of 196.37 g/mol. Its IUPAC name is (1-ethynylcyclohexyl)oxy-trimethylsilane.

Molecular Properties

Compound Name(1-ethynylcyclohexyl)oxy-trimethylsilane
PubChem CID552482
Molecular FormulaC11H20OSi
Molecular Weight196.37 g/mol
Exact Mass196.13
IUPAC Name(1-ethynylcyclohexyl)oxy-trimethylsilane
SMILESC#CC1(O[Si](C)(C)C)CCCCC1
InChIInChI=1S/C11H20OSi/c1-5-11(12-13(2,3)4)9-7-6-8-10-11/h1H,6-10H2,2-4H3
InChIKeyKJDMMCYMVUTZSN-UHFFFAOYSA-N
XLogP3.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.37
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-ethynylcyclohexyl)oxy-trimethylsilane?
The IUPAC name of (1-ethynylcyclohexyl)oxy-trimethylsilane (CID 552482) is (1-ethynylcyclohexyl)oxy-trimethylsilane.
What is the SMILES notation for (1-ethynylcyclohexyl)oxy-trimethylsilane?
The canonical SMILES for (1-ethynylcyclohexyl)oxy-trimethylsilane is C#CC1(O[Si](C)(C)C)CCCCC1.
What is the InChIKey of (1-ethynylcyclohexyl)oxy-trimethylsilane?
The InChIKey is KJDMMCYMVUTZSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20OSi/c1-5-11(12-13(2,3)4)9-7-6-8-10-11/h1H,6-10H2,2-4H3.
What are the key properties of (1-ethynylcyclohexyl)oxy-trimethylsilane?
(1-ethynylcyclohexyl)oxy-trimethylsilane has a molecular weight of 196.37 g/mol, XLogP of 3.17, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethynylcyclohexyl)oxy-trimethylsilane is sourced from PubChem (CID 552482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).