but-3-en-1-ynyl(triethyl)silane

C10H18Si — CID 573021

IUPACbut-3-en-1-ynyl(triethyl)silane
SMILESC=CC#C[Si](CC)(CC)CC
InChIInChI=1S/C10H18Si/c1-5-9-10-11(6-2,7-3)8-4/h5H,1,6-8H2,2-4H3
InChIKeyOCSDOQKTMLTTJV-UHFFFAOYSA-N
MW166.34 g/mol
LogP3.22
Rot. Bonds3

About but-3-en-1-ynyl(triethyl)silane

but-3-en-1-ynyl(triethyl)silane (PubChem CID 573021) has the molecular formula C10H18Si and a molecular weight of 166.34 g/mol. Its IUPAC name is but-3-en-1-ynyl(triethyl)silane.

Molecular Properties

Compound Namebut-3-en-1-ynyl(triethyl)silane
PubChem CID573021
Molecular FormulaC10H18Si
Molecular Weight166.34 g/mol
Exact Mass166.12
IUPAC Namebut-3-en-1-ynyl(triethyl)silane
SMILESC=CC#C[Si](CC)(CC)CC
InChIInChI=1S/C10H18Si/c1-5-9-10-11(6-2,7-3)8-4/h5H,1,6-8H2,2-4H3
InChIKeyOCSDOQKTMLTTJV-UHFFFAOYSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.34
LogP ≤ 53.22
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 but-3-en-1-ynyl(triethyl)silane?
The IUPAC name of but-3-en-1-ynyl(triethyl)silane (CID 573021) is but-3-en-1-ynyl(triethyl)silane.
What is the SMILES notation for but-3-en-1-ynyl(triethyl)silane?
The canonical SMILES for but-3-en-1-ynyl(triethyl)silane is C=CC#C[Si](CC)(CC)CC.
What is the InChIKey of but-3-en-1-ynyl(triethyl)silane?
The InChIKey is OCSDOQKTMLTTJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18Si/c1-5-9-10-11(6-2,7-3)8-4/h5H,1,6-8H2,2-4H3.
What are the key properties of but-3-en-1-ynyl(triethyl)silane?
but-3-en-1-ynyl(triethyl)silane has a molecular weight of 166.34 g/mol, XLogP of 3.22, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-en-1-ynyl(triethyl)silane is sourced from PubChem (CID 573021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).