tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane

C19H36O2Si2 — CID 91741364

IUPACtert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane
SMILESCc1cc(O[Si](C)(C)C(C)(C)C)cc(O[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C19H36O2Si2/c1-15-12-16(20-22(8,9)18(2,3)4)14-17(13-15)21-23(10,11)19(5,6)7/h12-14H,1-11H3
InChIKeyFTCQILXPSZTMJG-UHFFFAOYSA-N
MW352.67 g/mol
LogP6.76
Rot. Bonds4

About tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane

tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane (PubChem CID 91741364) has the molecular formula C19H36O2Si2 and a molecular weight of 352.67 g/mol. Its IUPAC name is tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane
PubChem CID91741364
Molecular FormulaC19H36O2Si2
Molecular Weight352.67 g/mol
Exact Mass352.23
IUPAC Nametert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane
SMILESCc1cc(O[Si](C)(C)C(C)(C)C)cc(O[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C19H36O2Si2/c1-15-12-16(20-22(8,9)18(2,3)4)14-17(13-15)21-23(10,11)19(5,6)7/h12-14H,1-11H3
InChIKeyFTCQILXPSZTMJG-UHFFFAOYSA-N
XLogP6.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.67
LogP ≤ 56.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane (CID 91741364) is tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane is Cc1cc(O[Si](C)(C)C(C)(C)C)cc(O[Si](C)(C)C(C)(C)C)c1.
What is the InChIKey of tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane?
The InChIKey is FTCQILXPSZTMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36O2Si2/c1-15-12-16(20-22(8,9)18(2,3)4)14-17(13-15)21-23(10,11)19(5,6)7/h12-14H,1-11H3.
What are the key properties of tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane?
tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane has a molecular weight of 352.67 g/mol, XLogP of 6.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-5-methylphenoxy]-dimethylsilane is sourced from PubChem (CID 91741364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).