trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane

C50H68O6Si7 — CID 159766078

IUPACtrimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane
SMILESC[Si](C)(C)O[Si](C)(O[Si](O[Si](C)(C)C)(c1ccccc1)c1ccccc1)c1ccccc1.C[Si]1(C)CCCCO[Si](C)(c2ccccc2)O[Si](c2ccccc2)(c2ccccc2)O1
InChIInChI=1S/C25H36O3Si4.C25H32O3Si3/c1-29(2,3)26-31(7,23-17-11-8-12-18-23)28-32(27-30(4,5)6,24-19-13-9-14-20-24)25-21-15-10-16-22-25;1-29(2)22-14-13-21-26-30(3,23-15-7-4-8-16-23)28-31(27-29,24-17-9-5-10-18-24)25-19-11-6-12-20-25/h8-22H,1-7H3;4-12,15-20H,13-14,21-22H2,1-3H3
InChIKeyNFNBNEMFFCGHEZ-UHFFFAOYSA-N
MW961.69 g/mol
LogP9.21
Rot. Bonds12

About trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane

trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane (PubChem CID 159766078) has the molecular formula C50H68O6Si7 and a molecular weight of 961.69 g/mol. Its IUPAC name is trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane.

Molecular Properties

Compound Nametrimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane
PubChem CID159766078
Molecular FormulaC50H68O6Si7
Molecular Weight961.69 g/mol
Exact Mass960.34
IUPAC Nametrimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane
SMILESC[Si](C)(C)O[Si](C)(O[Si](O[Si](C)(C)C)(c1ccccc1)c1ccccc1)c1ccccc1.C[Si]1(C)CCCCO[Si](C)(c2ccccc2)O[Si](c2ccccc2)(c2ccccc2)O1
InChIInChI=1S/C25H36O3Si4.C25H32O3Si3/c1-29(2,3)26-31(7,23-17-11-8-12-18-23)28-32(27-30(4,5)6,24-19-13-9-14-20-24)25-21-15-10-16-22-25;1-29(2)22-14-13-21-26-30(3,23-15-7-4-8-16-23)28-31(27-29,24-17-9-5-10-18-24)25-19-11-6-12-20-25/h8-22H,1-7H3;4-12,15-20H,13-14,21-22H2,1-3H3
InChIKeyNFNBNEMFFCGHEZ-UHFFFAOYSA-N
XLogP9.21
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms63
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500961.69
LogP ≤ 59.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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 trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane?
The IUPAC name of trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane (CID 159766078) is trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane.
What is the SMILES notation for trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane?
The canonical SMILES for trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane is C[Si](C)(C)O[Si](C)(O[Si](O[Si](C)(C)C)(c1ccccc1)c1ccccc1)c1ccccc1.C[Si]1(C)CCCCO[Si](C)(c2ccccc2)O[Si](c2ccccc2)(c2ccccc2)O1.
What is the InChIKey of trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane?
The InChIKey is NFNBNEMFFCGHEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H36O3Si4.C25H32O3Si3/c1-29(2,3)26-31(7,23-17-11-8-12-18-23)28-32(27-30(4,5)6,24-19-13-9-14-20-24)25-21-15-10-16-22-25;1-29(2)22-14-13-21-26-30(3,23-15-7-4-8-16-23)28-31(27-29,24-17-9-5-10-18-24)25-19-11-6-12-20-25/h8-22H,1-7H3;4-12,15-20H,13-14,21-22H2,1-3H3.
What are the key properties of trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane?
trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane has a molecular weight of 961.69 g/mol, XLogP of 9.21, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(methyl-phenyl-trimethylsilyloxysilyl)oxy-diphenylsilyl]oxysilane;2,6,6-trimethyl-2,4,4-triphenyl-1,3,5,2,4,6-trioxatrisilecane is sourced from PubChem (CID 159766078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).