tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane

C20H38O2Si2 — CID 10959526

IUPACtert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane
SMILESC#CC(C)(O[Si](C)(C)C(C)(C)C)C(C)(C#C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H38O2Si2/c1-15-19(9,21-23(11,12)17(3,4)5)20(10,16-2)22-24(13,14)18(6,7)8/h1-2H,3-14H3
InChIKeyOGZWZQPYRRLXJU-UHFFFAOYSA-N
MW366.69 g/mol
LogP5.81
Rot. Bonds5

About tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane

tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane (PubChem CID 10959526) has the molecular formula C20H38O2Si2 and a molecular weight of 366.69 g/mol. Its IUPAC name is tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane
PubChem CID10959526
Molecular FormulaC20H38O2Si2
Molecular Weight366.69 g/mol
Exact Mass366.24
IUPAC Nametert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane
SMILESC#CC(C)(O[Si](C)(C)C(C)(C)C)C(C)(C#C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H38O2Si2/c1-15-19(9,21-23(11,12)17(3,4)5)20(10,16-2)22-24(13,14)18(6,7)8/h1-2H,3-14H3
InChIKeyOGZWZQPYRRLXJU-UHFFFAOYSA-N
XLogP5.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.69
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

Bis(1,1-dimethyl-2-propynyloxy)dimethylsilane
CID 155887695
Dimethyl-(3-methyl-3-trimethylsilyloxypent-1-ynyl)-trimethylsilyloxysilane
CID 87600760
Tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxy-1,10-dimethylcyclodeca-2,8-diyn-1-yl]oxy-dimethylsilane
CID 102069978
Tert-butyl-[11-[tert-butyl(dimethyl)silyl]oxy-1,11-dimethylcycloundeca-2,9-diyn-1-yl]oxy-dimethylsilane
CID 102069979
Trimethyl-[2-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane
CID 54445108
Trimethyl-[1-[tris(2-methylbut-3-yn-2-yloxy)silyl]ethyl]silane
CID 57075904
Dimethyl-(3-methyl-3-trimethylsilyloxypent-4-ynyl)-trimethylsilyloxysilane
CID 87600761
[Ethyl(oxo)silyl]methyl-dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxysilane
CID 90246536
Butyl-[3-[dimethyl(2-trimethylsilyloxypropan-2-yl)silyl]oxy-2,3-dimethylbutan-2-yl]-methyl-(2-trimethylsilylpropan-2-yloxy)silane
CID 90761701
Dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane
CID 91278748
[3-[Dimethyl(2-trimethylsilyloxypropan-2-yl)silyl]-2,3-dimethylbutan-2-yl]-[3-[dimethyl(2-trimethylsilylpropan-2-yloxy)silyl]-2,3-dimethylbutan-2-yl]oxy-dimethylsilane
CID 123354896
[3-[Dimethyl(2-trimethylsilyloxypropan-2-yl)silyl]oxy-2,3-dimethylbutan-2-yl]-dimethyl-(2-trimethylsilylpropan-2-yloxy)silane
CID 123837517

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane (CID 10959526) is tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane is C#CC(C)(O[Si](C)(C)C(C)(C)C)C(C)(C#C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane?
The InChIKey is OGZWZQPYRRLXJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38O2Si2/c1-15-19(9,21-23(11,12)17(3,4)5)20(10,16-2)22-24(13,14)18(6,7)8/h1-2H,3-14H3.
What are the key properties of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane?
tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane has a molecular weight of 366.69 g/mol, XLogP of 5.81, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane is sourced from PubChem (CID 10959526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).