2-(cyclohexen-1-yl)ethynyl-trimethylsilane

C11H18Si — CID 11816203

IUPAC2-(cyclohexen-1-yl)ethynyl-trimethylsilane
SMILESC[Si](C)(C)C#CC1=CCCCC1
InChIInChI=1S/C11H18Si/c1-12(2,3)10-9-11-7-5-4-6-8-11/h7H,4-6,8H2,1-3H3
InChIKeyVDHSOMUGLNLVQN-UHFFFAOYSA-N
MW178.35 g/mol
LogP3.37
Rot. Bonds

About 2-(cyclohexen-1-yl)ethynyl-trimethylsilane

2-(cyclohexen-1-yl)ethynyl-trimethylsilane (PubChem CID 11816203) has the molecular formula C11H18Si and a molecular weight of 178.35 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)ethynyl-trimethylsilane.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)ethynyl-trimethylsilane
PubChem CID11816203
Molecular FormulaC11H18Si
Molecular Weight178.35 g/mol
Exact Mass178.12
IUPAC Name2-(cyclohexen-1-yl)ethynyl-trimethylsilane
SMILESC[Si](C)(C)C#CC1=CCCCC1
InChIInChI=1S/C11H18Si/c1-12(2,3)10-9-11-7-5-4-6-8-11/h7H,4-6,8H2,1-3H3
InChIKeyVDHSOMUGLNLVQN-UHFFFAOYSA-N
XLogP3.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.35
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 2-(cyclohexen-1-yl)ethynyl-trimethylsilane?
The IUPAC name of 2-(cyclohexen-1-yl)ethynyl-trimethylsilane (CID 11816203) is 2-(cyclohexen-1-yl)ethynyl-trimethylsilane.
What is the SMILES notation for 2-(cyclohexen-1-yl)ethynyl-trimethylsilane?
The canonical SMILES for 2-(cyclohexen-1-yl)ethynyl-trimethylsilane is C[Si](C)(C)C#CC1=CCCCC1.
What is the InChIKey of 2-(cyclohexen-1-yl)ethynyl-trimethylsilane?
The InChIKey is VDHSOMUGLNLVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18Si/c1-12(2,3)10-9-11-7-5-4-6-8-11/h7H,4-6,8H2,1-3H3.
What are the key properties of 2-(cyclohexen-1-yl)ethynyl-trimethylsilane?
2-(cyclohexen-1-yl)ethynyl-trimethylsilane has a molecular weight of 178.35 g/mol, XLogP of 3.37, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)ethynyl-trimethylsilane is sourced from PubChem (CID 11816203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).