ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane

C9H16Si2 — CID 16655851

IUPACethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane
SMILESC#C[Si](C)(C)C[Si](C)(C)C#C
InChIInChI=1S/C9H16Si2/c1-7-10(3,4)9-11(5,6)8-2/h1-2H,9H2,3-6H3
InChIKeyVTOPPNIJZITLQD-UHFFFAOYSA-N
MW180.40 g/mol
LogP2.29
Rot. Bonds2

About ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane

ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane (PubChem CID 16655851) has the molecular formula C9H16Si2 and a molecular weight of 180.40 g/mol. Its IUPAC name is ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane.

Molecular Properties

Compound Nameethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane
PubChem CID16655851
Molecular FormulaC9H16Si2
Molecular Weight180.40 g/mol
Exact Mass180.08
IUPAC Nameethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane
SMILESC#C[Si](C)(C)C[Si](C)(C)C#C
InChIInChI=1S/C9H16Si2/c1-7-10(3,4)9-11(5,6)8-2/h1-2H,9H2,3-6H3
InChIKeyVTOPPNIJZITLQD-UHFFFAOYSA-N
XLogP2.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.40
LogP ≤ 52.29
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 ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane?
The IUPAC name of ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane (CID 16655851) is ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane.
What is the SMILES notation for ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane?
The canonical SMILES for ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane is C#C[Si](C)(C)C[Si](C)(C)C#C.
What is the InChIKey of ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane?
The InChIKey is VTOPPNIJZITLQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16Si2/c1-7-10(3,4)9-11(5,6)8-2/h1-2H,9H2,3-6H3.
What are the key properties of ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane?
ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane has a molecular weight of 180.40 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethynyl-[[ethynyl(dimethyl)silyl]methyl]-dimethylsilane is sourced from PubChem (CID 16655851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).