tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane

C22H46O2Si3 — CID 24795264

IUPACtert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC1=C[Si](C)(C)C(CCO[Si](C)(C)C(C)(C)C)=C1
InChIInChI=1S/C22H46O2Si3/c1-21(2,3)26(9,10)23-15-13-19-17-20(25(7,8)18-19)14-16-24-27(11,12)22(4,5)6/h17-18H,13-16H2,1-12H3
InChIKeyOULYBVRALAXCTH-UHFFFAOYSA-N
MW426.87 g/mol
LogP7.46
Rot. Bonds8

About tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane

tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane (PubChem CID 24795264) has the molecular formula C22H46O2Si3 and a molecular weight of 426.87 g/mol. Its IUPAC name is tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane
PubChem CID24795264
Molecular FormulaC22H46O2Si3
Molecular Weight426.87 g/mol
Exact Mass426.28
IUPAC Nametert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC1=C[Si](C)(C)C(CCO[Si](C)(C)C(C)(C)C)=C1
InChIInChI=1S/C22H46O2Si3/c1-21(2,3)26(9,10)23-15-13-19-17-20(25(7,8)18-19)14-16-24-27(11,12)22(4,5)6/h17-18H,13-16H2,1-12H3
InChIKeyOULYBVRALAXCTH-UHFFFAOYSA-N
XLogP7.46
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.87
LogP ≤ 57.46
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

tert-butyl-dimethyl-[(4E,6E,8E)-trideca-4,6,8,12-tetraenoxy]silane
CID 134866952
[(2E)-3,7-dimethyl-2-[1-tri(propan-2-yl)silyloxyethenyl]octa-2,6-dienoxy]-tri(propan-2-yl)silane
CID 11168137
tert-butyl-[(2R,3E,5E)-2,4-dimethyldeca-3,5-dienoxy]-dimethylsilane
CID 11208696
[(4Z,6E)-7,11-dimethyldodeca-4,6,10-trienoxy]-tri(propan-2-yl)silane
CID 11279999
tert-butyl-dimethyl-[(E)-3-methyl-8-trimethylsilyloct-3-en-7-ynoxy]silane
CID 11438740
tert-butyl-[(2R,3Z,5E)-2,4-dimethyldeca-3,5-dienoxy]-dimethylsilane
CID 101267045
tert-butyl-[(2R,3E,5Z)-2,4-dimethyldeca-3,5-dienoxy]-dimethylsilane
CID 101732974
tert-butyl-[(4E,8E)-12-[tert-butyl(dimethyl)silyl]oxydodeca-4,8-dienoxy]-dimethylsilane
CID 134830594
tert-butyl-dimethyl-[(4E,6E,8E,12E)-pentadeca-4,6,8,12,14-pentaenoxy]silane
CID 134866917
tert-butyl-[(2R,3Z,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane
CID 134982626
tert-butyl-[(2R,3E,5E)-4-ethyl-2-methyl-8-trimethylsilylocta-3,5-dien-7-ynoxy]-dimethylsilane
CID 134982724
tert-butyl-[(5E)-5-[(2E)-2-ethylidenecyclopentylidene]pentoxy]-dimethylsilane
CID 134982740

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane (CID 24795264) is tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCCC1=C[Si](C)(C)C(CCO[Si](C)(C)C(C)(C)C)=C1.
What is the InChIKey of tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane?
The InChIKey is OULYBVRALAXCTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46O2Si3/c1-21(2,3)26(9,10)23-15-13-19-17-20(25(7,8)18-19)14-16-24-27(11,12)22(4,5)6/h17-18H,13-16H2,1-12H3.
What are the key properties of tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane?
tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane has a molecular weight of 426.87 g/mol, XLogP of 7.46, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,1-dimethylsilol-2-yl]ethoxy]-dimethylsilane is sourced from PubChem (CID 24795264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).