tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane

C20H38O2Si2 — CID 11100658

IUPACtert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)c1ccccc1
InChIInChI=1S/C20H38O2Si2/c1-19(2,3)23(7,8)21-16-18(17-14-12-11-13-15-17)22-24(9,10)20(4,5)6/h11-15,18H,16H2,1-10H3
InChIKeyGRPZAUUJAZEUJM-UHFFFAOYSA-N
MW366.69 g/mol
LogP6.77
Rot. Bonds6

About tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane

tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane (PubChem CID 11100658) has the molecular formula C20H38O2Si2 and a molecular weight of 366.69 g/mol. Its IUPAC name is tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane
PubChem CID11100658
Molecular FormulaC20H38O2Si2
Molecular Weight366.69 g/mol
Exact Mass366.24
IUPAC Nametert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)c1ccccc1
InChIInChI=1S/C20H38O2Si2/c1-19(2,3)23(7,8)21-16-18(17-14-12-11-13-15-17)22-24(9,10)20(4,5)6/h11-15,18H,16H2,1-10H3
InChIKeyGRPZAUUJAZEUJM-UHFFFAOYSA-N
XLogP6.77
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.69
LogP ≤ 56.77
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

Benzyloxytrimethylsilane
CID 518982
Benzene, [1-[(trimethylsilyl)oxy]ethenyl]-
CID 117406
Tert-butyl[(4-iodophenyl)methoxy]dimethylsilane
CID 10020633
1,1-Dimethyl-1,3-dihydrobenzo[c][1,2]oxasilole
CID 13085174
Silane, trimethyl(2-phenylethoxy)-
CID 518978
Benzeneacetic acid, alpha-[(tert-butyldimethylsilyl)oxy]-, tert-butyldimethylsilyl ester
CID 528583
Silane, triethyl(phenylmethoxy)-
CID 563229
Triethylsilyloxymethyl-4-fluorobenzene
CID 11107483
2,2,2-Trifluoro-1-phenylethyl trimethylsilyl ether
CID 11218868
tert-Butyl(4-fluorobenzyloxy)dimethylsilane
CID 13861700
Silane, trimethyl(1-phenylethoxy)-
CID 519015
1,2-Ethanediol, phenyl, bis-TMS
CID 530367

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane (CID 11100658) is tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCC(O[Si](C)(C)C(C)(C)C)c1ccccc1.
What is the InChIKey of tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane?
The InChIKey is GRPZAUUJAZEUJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38O2Si2/c1-19(2,3)23(7,8)21-16-18(17-14-12-11-13-15-17)22-24(9,10)20(4,5)6/h11-15,18H,16H2,1-10H3.
What are the key properties of tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane?
tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane has a molecular weight of 366.69 g/mol, XLogP of 6.77, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1-phenylethoxy]-dimethylsilane is sourced from PubChem (CID 11100658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).