tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane

C17H40O2Si2 — CID 91719412

IUPACtert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane
SMILESCC(CCO[Si](C)(C)C(C)(C)C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H40O2Si2/c1-15(14-19-21(10,11)17(5,6)7)12-13-18-20(8,9)16(2,3)4/h15H,12-14H2,1-11H3
InChIKeyAAKUYULPBBAIEF-UHFFFAOYSA-N
MW332.68 g/mol
LogP6.06
Rot. Bonds7

About tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane

tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane (PubChem CID 91719412) has the molecular formula C17H40O2Si2 and a molecular weight of 332.68 g/mol. Its IUPAC name is tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane
PubChem CID91719412
Molecular FormulaC17H40O2Si2
Molecular Weight332.68 g/mol
Exact Mass332.26
IUPAC Nametert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane
SMILESCC(CCO[Si](C)(C)C(C)(C)C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H40O2Si2/c1-15(14-19-21(10,11)17(5,6)7)12-13-18-20(8,9)16(2,3)4/h15H,12-14H2,1-11H3
InChIKeyAAKUYULPBBAIEF-UHFFFAOYSA-N
XLogP6.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.68
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1,4-butanediol, tBDMS
CID 6430201
Silane, diethyldi(3-methylbutoxy)-
CID 18990601
Silane, dimethyl(dimethyl(2-methylbutoxy)silyloxy)(2-methylbutoxy)-
CID 54770545
1,7-Di(2-methylbutyl)-2,2,4,4,6,6-hexamethyl-1,3,5,7-tetraoxa-2,4,6-trisilaheptane
CID 91696082
Silane, diethyldi(2-methyl-4-methoxybutoxy)-
CID 91710764
Silane, diethyl(2-methyl-4-methoxybutoxy)propoxy-
CID 91719410
Silane, dimethyl(dimethyl(2-ethylbutoxy)silyloxy)(2-ethylbutoxy)-
CID 91721106
Silane, diethylbutoxy(2-methyl-4-methoxybutoxy)-
CID 91723791
Silane, dimethyl(dimethyl(4-methoxy-2-methylbutoxy)silyloxy)(4-methoxy-2-methylbutoxy)-
CID 91723912
Silane, diethyl(2-methyl-4-methoxybutoxy)pentyloxy-
CID 91726790
Silane, diethylethoxy(2-methylbutoxy)-
CID 91730320
Silane, diethylethoxy(3-methylbutoxy)-
CID 91730328

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane (CID 91719412) is tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane is CC(CCO[Si](C)(C)C(C)(C)C)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane?
The InChIKey is AAKUYULPBBAIEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H40O2Si2/c1-15(14-19-21(10,11)17(5,6)7)12-13-18-20(8,9)16(2,3)4/h15H,12-14H2,1-11H3.
What are the key properties of tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane?
tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-2-methylbutoxy]-dimethylsilane has a molecular weight of 332.68 g/mol, XLogP of 6.06, 7 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-2-methylbutoxy]-dimethylsilane is sourced from PubChem (CID 91719412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).