trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane

C20H42O2Si2 — CID 91696953

IUPACtrimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane
SMILESCC(C)CC(C)(C#CC(C)(CC(C)C)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C20H42O2Si2/c1-17(2)15-19(5,21-23(7,8)9)13-14-20(6,16-18(3)4)22-24(10,11)12/h17-18H,15-16H2,1-12H3
InChIKeyKULKYKKVQOKKFD-UHFFFAOYSA-N
MW370.73 g/mol
LogP6.30
Rot. Bonds8

About trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane

trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane (PubChem CID 91696953) has the molecular formula C20H42O2Si2 and a molecular weight of 370.73 g/mol. Its IUPAC name is trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane.

Molecular Properties

Compound Nametrimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane
PubChem CID91696953
Molecular FormulaC20H42O2Si2
Molecular Weight370.73 g/mol
Exact Mass370.27
IUPAC Nametrimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane
SMILESCC(C)CC(C)(C#CC(C)(CC(C)C)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C20H42O2Si2/c1-17(2)15-19(5,21-23(7,8)9)13-14-20(6,16-18(3)4)22-24(10,11)12/h17-18H,15-16H2,1-12H3
InChIKeyKULKYKKVQOKKFD-UHFFFAOYSA-N
XLogP6.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.73
LogP ≤ 56.30
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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Frequently Asked Questions

What is the IUPAC name of trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane?
The IUPAC name of trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane (CID 91696953) is trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane.
What is the SMILES notation for trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane?
The canonical SMILES for trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane is CC(C)CC(C)(C#CC(C)(CC(C)C)O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane?
The InChIKey is KULKYKKVQOKKFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O2Si2/c1-17(2)15-19(5,21-23(7,8)9)13-14-20(6,16-18(3)4)22-24(10,11)12/h17-18H,15-16H2,1-12H3.
What are the key properties of trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane?
trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane has a molecular weight of 370.73 g/mol, XLogP of 6.30, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-yl)oxysilane is sourced from PubChem (CID 91696953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).