tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane

C20H38O2Si2 — CID 100946322

IUPACtert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane
SMILESCC[Si](CC)(CC)OCCc1ccc(O[Si](C)(C)C(C)(C)C)cc1
InChIInChI=1S/C20H38O2Si2/c1-9-24(10-2,11-3)21-17-16-18-12-14-19(15-13-18)22-23(7,8)20(4,5)6/h12-15H,9-11,16-17H2,1-8H3
InChIKeyWHSVFSVBFOKQNB-UHFFFAOYSA-N
MW366.69 g/mol
LogP6.63
Rot. Bonds9

About tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane

tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane (PubChem CID 100946322) has the molecular formula C20H38O2Si2 and a molecular weight of 366.69 g/mol. Its IUPAC name is tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane
PubChem CID100946322
Molecular FormulaC20H38O2Si2
Molecular Weight366.69 g/mol
Exact Mass366.24
IUPAC Nametert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane
SMILESCC[Si](CC)(CC)OCCc1ccc(O[Si](C)(C)C(C)(C)C)cc1
InChIInChI=1S/C20H38O2Si2/c1-9-24(10-2,11-3)21-17-16-18-12-14-19(15-13-18)22-23(7,8)20(4,5)6/h12-15H,9-11,16-17H2,1-8H3
InChIKeyWHSVFSVBFOKQNB-UHFFFAOYSA-N
XLogP6.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.69
LogP ≤ 56.63
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-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane (CID 100946322) is tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane is CC[Si](CC)(CC)OCCc1ccc(O[Si](C)(C)C(C)(C)C)cc1.
What is the InChIKey of tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane?
The InChIKey is WHSVFSVBFOKQNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38O2Si2/c1-9-24(10-2,11-3)21-17-16-18-12-14-19(15-13-18)22-23(7,8)20(4,5)6/h12-15H,9-11,16-17H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane?
tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane has a molecular weight of 366.69 g/mol, XLogP of 6.63, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[4-(2-triethylsilyloxyethyl)phenoxy]silane is sourced from PubChem (CID 100946322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).