trimethyl(octa-3,4-dien-1-ynyl)silane

C11H18Si — CID 13028939

IUPACtrimethyl(octa-3,4-dien-1-ynyl)silane
SMILESCCCC=C=CC#C[Si](C)(C)C
InChIInChI=1S/C11H18Si/c1-5-6-7-8-9-10-11-12(2,3)4/h7,9H,5-6H2,1-4H3
InChIKeyJMFGHOMWVGOVES-UHFFFAOYSA-N
MW178.35 g/mol
LogP3.38
Rot. Bonds2

About trimethyl(octa-3,4-dien-1-ynyl)silane

trimethyl(octa-3,4-dien-1-ynyl)silane (PubChem CID 13028939) has the molecular formula C11H18Si and a molecular weight of 178.35 g/mol. Its IUPAC name is trimethyl(octa-3,4-dien-1-ynyl)silane.

Molecular Properties

Compound Nametrimethyl(octa-3,4-dien-1-ynyl)silane
PubChem CID13028939
Molecular FormulaC11H18Si
Molecular Weight178.35 g/mol
Exact Mass178.12
IUPAC Nametrimethyl(octa-3,4-dien-1-ynyl)silane
SMILESCCCC=C=CC#C[Si](C)(C)C
InChIInChI=1S/C11H18Si/c1-5-6-7-8-9-10-11-12(2,3)4/h7,9H,5-6H2,1-4H3
InChIKeyJMFGHOMWVGOVES-UHFFFAOYSA-N
XLogP3.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.35
LogP ≤ 53.38
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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Related Compounds

Silane, trimethyl-4-pentenyl-
CID 552697
Silane, triethyl-1-pentenyl-
CID 5371606
trimethyl-[(E)-pent-1-enyl]silane
CID 11105474
Triethyl(hept-6-en-1-yn-1-yl)silane
CID 112756414
Pentenyltriethylsilane
CID 581552
Hept-6-en-1-ynyl(trimethyl)silane
CID 10678786
Triethyl(pent-4-enyl)silane
CID 14931866
Hex-5-en-1-yn-1-yltriisopropylsilane
CID 58460841
Hexa-1,2-dienyl(trimethyl)silane
CID 10519640
Hexa-1,5-dien-2-yl(trimethyl)silane
CID 10877347
Trimethyl(octa-6,7-dien-1-ynyl)silane
CID 10932018
Dodeca-5,6-dien-1-ynyl(trimethyl)silane
CID 11075369

Frequently Asked Questions

What is the IUPAC name of trimethyl(octa-3,4-dien-1-ynyl)silane?
The IUPAC name of trimethyl(octa-3,4-dien-1-ynyl)silane (CID 13028939) is trimethyl(octa-3,4-dien-1-ynyl)silane.
What is the SMILES notation for trimethyl(octa-3,4-dien-1-ynyl)silane?
The canonical SMILES for trimethyl(octa-3,4-dien-1-ynyl)silane is CCCC=C=CC#C[Si](C)(C)C.
What is the InChIKey of trimethyl(octa-3,4-dien-1-ynyl)silane?
The InChIKey is JMFGHOMWVGOVES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18Si/c1-5-6-7-8-9-10-11-12(2,3)4/h7,9H,5-6H2,1-4H3.
What are the key properties of trimethyl(octa-3,4-dien-1-ynyl)silane?
trimethyl(octa-3,4-dien-1-ynyl)silane has a molecular weight of 178.35 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(octa-3,4-dien-1-ynyl)silane is sourced from PubChem (CID 13028939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).