tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane

C14H34OSi2 — CID 87069102

IUPACtert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane
SMILESCC[Si](C)(O[Si](C)(CC)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C14H34OSi2/c1-11-16(9,13(3,4)5)15-17(10,12-2)14(6,7)8/h11-12H2,1-10H3
InChIKeySEOKRSCVBBFQND-UHFFFAOYSA-N
MW274.60 g/mol
LogP5.79
Rot. Bonds4

About tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane

tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane (PubChem CID 87069102) has the molecular formula C14H34OSi2 and a molecular weight of 274.60 g/mol. Its IUPAC name is tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane.

Molecular Properties

Compound Nametert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane
PubChem CID87069102
Molecular FormulaC14H34OSi2
Molecular Weight274.60 g/mol
Exact Mass274.21
IUPAC Nametert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane
SMILESCC[Si](C)(O[Si](C)(CC)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C14H34OSi2/c1-11-16(9,13(3,4)5)15-17(10,12-2)14(6,7)8/h11-12H2,1-10H3
InChIKeySEOKRSCVBBFQND-UHFFFAOYSA-N
XLogP5.79
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.60
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane?
The IUPAC name of tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane (CID 87069102) is tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane.
What is the SMILES notation for tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane?
The canonical SMILES for tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane is CC[Si](C)(O[Si](C)(CC)C(C)(C)C)C(C)(C)C.
What is the InChIKey of tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane?
The InChIKey is SEOKRSCVBBFQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H34OSi2/c1-11-16(9,13(3,4)5)15-17(10,12-2)14(6,7)8/h11-12H2,1-10H3.
What are the key properties of tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane?
tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane has a molecular weight of 274.60 g/mol, XLogP of 5.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(tert-butyl-ethyl-methylsilyl)oxy-ethyl-methylsilane is sourced from PubChem (CID 87069102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).