tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane

C46H50O2Si2 — CID 11028852

IUPACtert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
SMILESCC(C)(C)[Si](O[C@H](c1ccccc1)[C@H](O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C46H50O2Si2/c1-45(2,3)49(39-29-17-9-18-30-39,40-31-19-10-20-32-40)47-43(37-25-13-7-14-26-37)44(38-27-15-8-16-28-38)48-50(46(4,5)6,41-33-21-11-22-34-41)42-35-23-12-24-36-42/h7-36,43-44H,1-6H3/t43-,44-/m1/s1
InChIKeyFYCLXYWHUPLCEV-NDOUMJCMSA-N
MW691.08 g/mol
LogP9.62
Rot. Bonds11

About tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane

tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane (PubChem CID 11028852) has the molecular formula C46H50O2Si2 and a molecular weight of 691.08 g/mol. Its IUPAC name is tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
PubChem CID11028852
Molecular FormulaC46H50O2Si2
Molecular Weight691.08 g/mol
Exact Mass690.33
IUPAC Nametert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
SMILESCC(C)(C)[Si](O[C@H](c1ccccc1)[C@H](O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C46H50O2Si2/c1-45(2,3)49(39-29-17-9-18-30-39,40-31-19-10-20-32-40)47-43(37-25-13-7-14-26-37)44(38-27-15-8-16-28-38)48-50(46(4,5)6,41-33-21-11-22-34-41)42-35-23-12-24-36-42/h7-36,43-44H,1-6H3/t43-,44-/m1/s1
InChIKeyFYCLXYWHUPLCEV-NDOUMJCMSA-N
XLogP9.62
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500691.08
LogP ≤ 59.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl-pentan-3-yloxy-diphenylsilane
CID 58776136
(2R)-2-[tert-butyl(diphenyl)silyl]oxy-2-phenylacetonitrile
CID 18653746
N-[(1S,2S)-1-[tert-butyl(diphenyl)silyl]oxy-1-phenylpropan-2-yl]-2,2,2-trifluoroacetamide
CID 100993402
methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
CID 102172480
tert-butyl-[(E)-1,3-diphenylprop-2-enoxy]-diphenylsilane
CID 135009658
(2S,3R)-3-[tert-butyl(diphenyl)silyl]oxypent-4-en-2-ol
CID 102030687
3-[tert-butyl(diphenyl)silyl]oxypent-4-enal
CID 85402432
(1R,2S,4S)-4-[tert-butyl(diphenyl)silyl]oxy-1-hydroxy-2-methyl-1-phenylpentan-3-one
CID 101072666
[bromo-(3-chlorophenyl)methoxy]-tert-butyl-diphenylsilane
CID 56985578
(2S,3S)-3-[tert-butyl(diphenyl)silyl]oxy-2-methylpent-4-en-1-ol
CID 175160919
tert-butyl-diphenyl-trimethylsilyloxysilane
CID 3876189
tert-butyl-[(2Z,7Z)-nona-2,7-dien-5-yl]oxy-diphenylsilane
CID 58139640

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane (CID 11028852) is tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane is CC(C)(C)[Si](O[C@H](c1ccccc1)[C@H](O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane?
The InChIKey is FYCLXYWHUPLCEV-NDOUMJCMSA-N. The full InChI is InChI=1S/C46H50O2Si2/c1-45(2,3)49(39-29-17-9-18-30-39,40-31-19-10-20-32-40)47-43(37-25-13-7-14-26-37)44(38-27-15-8-16-28-38)48-50(46(4,5)6,41-33-21-11-22-34-41)42-35-23-12-24-36-42/h7-36,43-44H,1-6H3/t43-,44-/m1/s1.
What are the key properties of tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane?
tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane has a molecular weight of 691.08 g/mol, XLogP of 9.62, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane is sourced from PubChem (CID 11028852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).