tris[[methyl(phenyl)silyl]oxy]-phenylsilane

C27H32O3Si4 — CID 153174027

IUPACtris[[methyl(phenyl)silyl]oxy]-phenylsilane
SMILESC[SiH](O[Si](O[SiH](C)c1ccccc1)(O[SiH](C)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C27H32O3Si4/c1-31(24-16-8-4-9-17-24)28-34(27-22-14-7-15-23-27,29-32(2)25-18-10-5-11-19-25)30-33(3)26-20-12-6-13-21-26/h4-23,31-33H,1-3H3
InChIKeyWEUNBSMUCAMCDB-UHFFFAOYSA-N
MW516.89 g/mol
LogP2.66
Rot. Bonds10

About tris[[methyl(phenyl)silyl]oxy]-phenylsilane

tris[[methyl(phenyl)silyl]oxy]-phenylsilane (PubChem CID 153174027) has the molecular formula C27H32O3Si4 and a molecular weight of 516.89 g/mol. Its IUPAC name is tris[[methyl(phenyl)silyl]oxy]-phenylsilane.

Molecular Properties

Compound Nametris[[methyl(phenyl)silyl]oxy]-phenylsilane
PubChem CID153174027
Molecular FormulaC27H32O3Si4
Molecular Weight516.89 g/mol
Exact Mass516.14
IUPAC Nametris[[methyl(phenyl)silyl]oxy]-phenylsilane
SMILESC[SiH](O[Si](O[SiH](C)c1ccccc1)(O[SiH](C)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C27H32O3Si4/c1-31(24-16-8-4-9-17-24)28-34(27-22-14-7-15-23-27,29-32(2)25-18-10-5-11-19-25)30-33(3)26-20-12-6-13-21-26/h4-23,31-33H,1-3H3
InChIKeyWEUNBSMUCAMCDB-UHFFFAOYSA-N
XLogP2.66
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500516.89
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 tris[[methyl(phenyl)silyl]oxy]-phenylsilane?
The IUPAC name of tris[[methyl(phenyl)silyl]oxy]-phenylsilane (CID 153174027) is tris[[methyl(phenyl)silyl]oxy]-phenylsilane.
What is the SMILES notation for tris[[methyl(phenyl)silyl]oxy]-phenylsilane?
The canonical SMILES for tris[[methyl(phenyl)silyl]oxy]-phenylsilane is C[SiH](O[Si](O[SiH](C)c1ccccc1)(O[SiH](C)c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of tris[[methyl(phenyl)silyl]oxy]-phenylsilane?
The InChIKey is WEUNBSMUCAMCDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32O3Si4/c1-31(24-16-8-4-9-17-24)28-34(27-22-14-7-15-23-27,29-32(2)25-18-10-5-11-19-25)30-33(3)26-20-12-6-13-21-26/h4-23,31-33H,1-3H3.
What are the key properties of tris[[methyl(phenyl)silyl]oxy]-phenylsilane?
tris[[methyl(phenyl)silyl]oxy]-phenylsilane has a molecular weight of 516.89 g/mol, XLogP of 2.66, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tris[[methyl(phenyl)silyl]oxy]-phenylsilane is sourced from PubChem (CID 153174027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).