tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane

C32H38OSi2 — CID 58097772

IUPACtert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCCc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C32H38OSi2/c1-32(2,3)34(4,5)33-26-25-27-21-23-31(24-22-27)35(28-15-9-6-10-16-28,29-17-11-7-12-18-29)30-19-13-8-14-20-30/h6-24H,25-26H2,1-5H3
InChIKeyVMSLCLGLZATJQR-UHFFFAOYSA-N
MW494.83 g/mol
LogP5.63
Rot. Bonds8

About tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane

tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane (PubChem CID 58097772) has the molecular formula C32H38OSi2 and a molecular weight of 494.83 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane
PubChem CID58097772
Molecular FormulaC32H38OSi2
Molecular Weight494.83 g/mol
Exact Mass494.25
IUPAC Nametert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCCc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C32H38OSi2/c1-32(2,3)34(4,5)33-26-25-27-21-23-31(24-22-27)35(28-15-9-6-10-16-28,29-17-11-7-12-18-29)30-19-13-8-14-20-30/h6-24H,25-26H2,1-5H3
InChIKeyVMSLCLGLZATJQR-UHFFFAOYSA-N
XLogP5.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.83
LogP ≤ 55.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-(2-phenylethoxy)silane
CID 11128311
1-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]phenyl]ethanol
CID 70662083
tert-butyl-[3-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]propoxy]-diphenylsilane
CID 102246866
tert-butyl-[4-[dimethyl(phenyl)silyl]butoxy]-dimethylsilane
CID 102153241
tert-butyl-[2-[4-(2-hydroperoxypropan-2-yl)phenyl]ethoxy]-diphenylsilane
CID 88618126
2-(3-bromophenyl)ethoxy-tert-butyl-dimethylsilane
CID 11515183
4-[3-[tert-butyl(dimethyl)silyl]oxypropyl]aniline
CID 86731586
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentyl]-diphenylsilane
CID 11293613
4-butyl-N-[4-[2-[3-[tert-butyl(dimethyl)silyl]oxypropoxy]ethyl]phenyl]-N-phenylaniline
CID 11800072
tert-butyl-dimethyl-(2-phenylsulfanylethoxy)silane
CID 11346217
[2-bromo-4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]phenoxy]-tert-butyl-dimethylsilane
CID 102589109
tert-butyl-dimethyl-[2,2,3,3-tetradeuterio-3-(4-phenylphenyl)propoxy]silane
CID 163281797

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane (CID 58097772) is tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane is CC(C)(C)[Si](C)(C)OCCc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane?
The InChIKey is VMSLCLGLZATJQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H38OSi2/c1-32(2,3)34(4,5)33-26-25-27-21-23-31(24-22-27)35(28-15-9-6-10-16-28,29-17-11-7-12-18-29)30-19-13-8-14-20-30/h6-24H,25-26H2,1-5H3.
What are the key properties of tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane?
tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane has a molecular weight of 494.83 g/mol, XLogP of 5.63, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[2-(4-triphenylsilylphenyl)ethoxy]silane is sourced from PubChem (CID 58097772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).