trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane

C18H38O2Si2 — CID 21393000

IUPACtrimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane
SMILESC#CC(O[Si](CC)(CC)CC)C(C)(CCCC)O[Si](C)(C)C
InChIInChI=1S/C18H38O2Si2/c1-10-15-16-18(6,20-21(7,8)9)17(11-2)19-22(12-3,13-4)14-5/h2,17H,10,12-16H2,1,3-9H3
InChIKeyPXRDVPUGYKIXFX-UHFFFAOYSA-N
MW342.67 g/mol
LogP5.81
Rot. Bonds11

About trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane

trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane (PubChem CID 21393000) has the molecular formula C18H38O2Si2 and a molecular weight of 342.67 g/mol. Its IUPAC name is trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane.

Molecular Properties

Compound Nametrimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane
PubChem CID21393000
Molecular FormulaC18H38O2Si2
Molecular Weight342.67 g/mol
Exact Mass342.24
IUPAC Nametrimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane
SMILESC#CC(O[Si](CC)(CC)CC)C(C)(CCCC)O[Si](C)(C)C
InChIInChI=1S/C18H38O2Si2/c1-10-15-16-18(6,20-21(7,8)9)17(11-2)19-22(12-3,13-4)14-5/h2,17H,10,12-16H2,1,3-9H3
InChIKeyPXRDVPUGYKIXFX-UHFFFAOYSA-N
XLogP5.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.67
LogP ≤ 55.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane
CID 12801788
tert-butyl-dimethyl-[(4S)-oct-1-yn-4-yl]oxysilane
CID 129405343
triethyl(hepta-1,6-diyn-4-yloxy)silane
CID 102524422
trimethyl-[(3R)-oct-1-yn-3-yl]oxysilane
CID 129404520
triethyl-[(2S)-pent-4-yn-2-yl]oxysilane
CID 11052607
3-butyl-3-trimethylsilyloxyheptanenitrile
CID 87839604
trimethyl(non-1-yn-4-yloxy)silane
CID 10954874
triethyl-[(2R)-1,1,1-trichloropent-4-yn-2-yl]oxysilane
CID 101187830
2,3-dimethylpentan-3-yloxy(trimethyl)silane
CID 10679187
trimethyl(2-methylpent-4-yn-2-yloxy)silane
CID 11708134
(3S)-4,4-dimethyloct-1-yn-3-ol
CID 54523501
(4S,6R)-6-[tert-butyl(dimethyl)silyl]oxytridec-1-yn-4-ol
CID 57407601

Frequently Asked Questions

What is the IUPAC name of trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane?
The IUPAC name of trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane (CID 21393000) is trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane.
What is the SMILES notation for trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane?
The canonical SMILES for trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane is C#CC(O[Si](CC)(CC)CC)C(C)(CCCC)O[Si](C)(C)C.
What is the InChIKey of trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane?
The InChIKey is PXRDVPUGYKIXFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38O2Si2/c1-10-15-16-18(6,20-21(7,8)9)17(11-2)19-22(12-3,13-4)14-5/h2,17H,10,12-16H2,1,3-9H3.
What are the key properties of trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane?
trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane has a molecular weight of 342.67 g/mol, XLogP of 5.81, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane is sourced from PubChem (CID 21393000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).