tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane

C30H38O6Si4 — CID 54398329

IUPACtris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane
SMILESCO[Si](C)(O[Si](O[Si](C)(OC)c1ccccc1)(O[Si](C)(OC)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C30H38O6Si4/c1-31-37(4,27-19-11-7-12-20-27)34-40(30-25-17-10-18-26-30,35-38(5,32-2)28-21-13-8-14-22-28)36-39(6,33-3)29-23-15-9-16-24-29/h7-26H,1-6H3
InChIKeyVLPSYVZXIRUVTR-UHFFFAOYSA-N
MW606.97 g/mol
LogP3.76
Rot. Bonds13

About tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane

tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane (PubChem CID 54398329) has the molecular formula C30H38O6Si4 and a molecular weight of 606.97 g/mol. Its IUPAC name is tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane.

Molecular Properties

Compound Nametris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane
PubChem CID54398329
Molecular FormulaC30H38O6Si4
Molecular Weight606.97 g/mol
Exact Mass606.17
IUPAC Nametris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane
SMILESCO[Si](C)(O[Si](O[Si](C)(OC)c1ccccc1)(O[Si](C)(OC)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C30H38O6Si4/c1-31-37(4,27-19-11-7-12-20-27)34-40(30-25-17-10-18-26-30,35-38(5,32-2)28-21-13-8-14-22-28)36-39(6,33-3)29-23-15-9-16-24-29/h7-26H,1-6H3
InChIKeyVLPSYVZXIRUVTR-UHFFFAOYSA-N
XLogP3.76
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms40
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500606.97
LogP ≤ 53.76
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 tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane?
The IUPAC name of tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane (CID 54398329) is tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane.
What is the SMILES notation for tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane?
The canonical SMILES for tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane is CO[Si](C)(O[Si](O[Si](C)(OC)c1ccccc1)(O[Si](C)(OC)c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane?
The InChIKey is VLPSYVZXIRUVTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H38O6Si4/c1-31-37(4,27-19-11-7-12-20-27)34-40(30-25-17-10-18-26-30,35-38(5,32-2)28-21-13-8-14-22-28)36-39(6,33-3)29-23-15-9-16-24-29/h7-26H,1-6H3.
What are the key properties of tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane?
tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane has a molecular weight of 606.97 g/mol, XLogP of 3.76, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris[(methoxy-methyl-phenylsilyl)oxy]-phenylsilane is sourced from PubChem (CID 54398329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).