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

C14H24Si — CID 134948291

IUPAC2-(cyclohexen-1-yl)ethynyl-triethylsilane
SMILESCC[Si](C#CC1=CCCCC1)(CC)CC
InChIInChI=1S/C14H24Si/c1-4-15(5-2,6-3)13-12-14-10-8-7-9-11-14/h10H,4-9,11H2,1-3H3
InChIKeyKBTOOJLYPFWADT-UHFFFAOYSA-N
MW220.43 g/mol
LogP4.54
Rot. Bonds3

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

2-(cyclohexen-1-yl)ethynyl-triethylsilane (PubChem CID 134948291) has the molecular formula C14H24Si and a molecular weight of 220.43 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)ethynyl-triethylsilane.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)ethynyl-triethylsilane
PubChem CID134948291
Molecular FormulaC14H24Si
Molecular Weight220.43 g/mol
Exact Mass220.16
IUPAC Name2-(cyclohexen-1-yl)ethynyl-triethylsilane
SMILESCC[Si](C#CC1=CCCCC1)(CC)CC
InChIInChI=1S/C14H24Si/c1-4-15(5-2,6-3)13-12-14-10-8-7-9-11-14/h10H,4-9,11H2,1-3H3
InChIKeyKBTOOJLYPFWADT-UHFFFAOYSA-N
XLogP4.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.43
LogP ≤ 54.54
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-triethylsilane?
The IUPAC name of 2-(cyclohexen-1-yl)ethynyl-triethylsilane (CID 134948291) is 2-(cyclohexen-1-yl)ethynyl-triethylsilane.
What is the SMILES notation for 2-(cyclohexen-1-yl)ethynyl-triethylsilane?
The canonical SMILES for 2-(cyclohexen-1-yl)ethynyl-triethylsilane is CC[Si](C#CC1=CCCCC1)(CC)CC.
What is the InChIKey of 2-(cyclohexen-1-yl)ethynyl-triethylsilane?
The InChIKey is KBTOOJLYPFWADT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24Si/c1-4-15(5-2,6-3)13-12-14-10-8-7-9-11-14/h10H,4-9,11H2,1-3H3.
What are the key properties of 2-(cyclohexen-1-yl)ethynyl-triethylsilane?
2-(cyclohexen-1-yl)ethynyl-triethylsilane has a molecular weight of 220.43 g/mol, XLogP of 4.54, 3 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-triethylsilane is sourced from PubChem (CID 134948291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).