trimethyl(octa-6,7-dien-1-ynyl)silane

C11H18Si — CID 10932018

IUPACtrimethyl(octa-6,7-dien-1-ynyl)silane
SMILESC=C=CCCCC#C[Si](C)(C)C
InChIInChI=1S/C11H18Si/c1-5-6-7-8-9-10-11-12(2,3)4/h6H,1,7-9H2,2-4H3
InChIKeyNWARSFWYEWUBJU-UHFFFAOYSA-N
MW178.35 g/mol
LogP3.38
Rot. Bonds3

About trimethyl(octa-6,7-dien-1-ynyl)silane

trimethyl(octa-6,7-dien-1-ynyl)silane (PubChem CID 10932018) has the molecular formula C11H18Si and a molecular weight of 178.35 g/mol. Its IUPAC name is trimethyl(octa-6,7-dien-1-ynyl)silane.

Molecular Properties

Compound Nametrimethyl(octa-6,7-dien-1-ynyl)silane
PubChem CID10932018
Molecular FormulaC11H18Si
Molecular Weight178.35 g/mol
Exact Mass178.12
IUPAC Nametrimethyl(octa-6,7-dien-1-ynyl)silane
SMILESC=C=CCCCC#C[Si](C)(C)C
InChIInChI=1S/C11H18Si/c1-5-6-7-8-9-10-11-12(2,3)4/h6H,1,7-9H2,2-4H3
InChIKeyNWARSFWYEWUBJU-UHFFFAOYSA-N
XLogP3.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 trimethyl(octa-6,7-dien-1-ynyl)silane?
The IUPAC name of trimethyl(octa-6,7-dien-1-ynyl)silane (CID 10932018) is trimethyl(octa-6,7-dien-1-ynyl)silane.
What is the SMILES notation for trimethyl(octa-6,7-dien-1-ynyl)silane?
The canonical SMILES for trimethyl(octa-6,7-dien-1-ynyl)silane is C=C=CCCCC#C[Si](C)(C)C.
What is the InChIKey of trimethyl(octa-6,7-dien-1-ynyl)silane?
The InChIKey is NWARSFWYEWUBJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18Si/c1-5-6-7-8-9-10-11-12(2,3)4/h6H,1,7-9H2,2-4H3.
What are the key properties of trimethyl(octa-6,7-dien-1-ynyl)silane?
trimethyl(octa-6,7-dien-1-ynyl)silane has a molecular weight of 178.35 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(octa-6,7-dien-1-ynyl)silane is sourced from PubChem (CID 10932018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).