tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane

C20H42OSi2 — CID 134919365

IUPACtributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane
SMILESCCCC[Si](CCCC)(CCCC)OC#C[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H42OSi2/c1-9-12-16-23(17-13-10-2,18-14-11-3)21-15-19-22(7,8)20(4,5)6/h9-14,16-18H2,1-8H3
InChIKeyMBRQSPCAZUDOKX-UHFFFAOYSA-N
MW354.73 g/mol
LogP7.36
Rot. Bonds10

About tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane

tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane (PubChem CID 134919365) has the molecular formula C20H42OSi2 and a molecular weight of 354.73 g/mol. Its IUPAC name is tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane.

Molecular Properties

Compound Nametributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane
PubChem CID134919365
Molecular FormulaC20H42OSi2
Molecular Weight354.73 g/mol
Exact Mass354.28
IUPAC Nametributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane
SMILESCCCC[Si](CCCC)(CCCC)OC#C[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H42OSi2/c1-9-12-16-23(17-13-10-2,18-14-11-3)21-15-19-22(7,8)20(4,5)6/h9-14,16-18H2,1-8H3
InChIKeyMBRQSPCAZUDOKX-UHFFFAOYSA-N
XLogP7.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.73
LogP ≤ 57.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

1,1-Bis(trimethylsilyl)-2-trimethylsiloxy-2-t-butyl-1-silaethylene
CID 10958542
Tert-butyl-dimethyl-[7-tri(propan-2-yl)silylhepta-2,4,6-triynoxy]silane
CID 134970998
4,9-Dioxa-3,10-disiladodec-6-yne, 2,2,3,3,10,10,11,11-octamethyl-
CID 10757684
Tert-butyl(3-(tert-butyldimethylsilyl)prop-2-ynyloxy)-dimethylsilane
CID 10968062
Tert-butyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]-dimethylsilane
CID 10492305
Tert-butyl-dimethyl-[2-tri(propan-2-yl)silyloxyethynyl]silane
CID 10543167
Tert-butyl-[2-[2,3-dimethylbutan-2-yl(dimethyl)silyl]oxyethynyl]-dimethylsilane
CID 10685506
Trimethyl-[2-methyl-1,1-bis(trimethylsilyl)propoxy]silane
CID 12547101
Bis(dimethylpropoxysilylethynyl)dimethylsilane
CID 13442785
Tert-butyl-dimethyl-(2-trimethylsilyloxyethynyl)silane
CID 15306607
Trimethylsilyloxy(triisopropylsilyl)acetylene
CID 15306608
(Methoxydimethylsilyl)(trimethyl-silyl)(tri-t-butylsilyl)methane
CID 15326487

Frequently Asked Questions

What is the IUPAC name of tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane?
The IUPAC name of tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane (CID 134919365) is tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane.
What is the SMILES notation for tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane?
The canonical SMILES for tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane is CCCC[Si](CCCC)(CCCC)OC#C[Si](C)(C)C(C)(C)C.
What is the InChIKey of tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane?
The InChIKey is MBRQSPCAZUDOKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42OSi2/c1-9-12-16-23(17-13-10-2,18-14-11-3)21-15-19-22(7,8)20(4,5)6/h9-14,16-18H2,1-8H3.
What are the key properties of tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane?
tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane has a molecular weight of 354.73 g/mol, XLogP of 7.36, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-[2-[tert-butyl(dimethyl)silyl]ethynoxy]silane is sourced from PubChem (CID 134919365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).