bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane

C23H30O6Si3 — CID 90381313

IUPACbis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane
SMILESCO[Si](OC)(O[Si](C)(O[Si](OC)(OC)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H30O6Si3/c1-24-31(25-2,22-17-11-7-12-18-22)28-30(5,21-15-9-6-10-16-21)29-32(26-3,27-4)23-19-13-8-14-20-23/h6-20H,1-5H3
InChIKeyOJVWVNQQTBBQPM-UHFFFAOYSA-N
MW486.75 g/mol
LogP2.28
Rot. Bonds11

About bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane

bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane (PubChem CID 90381313) has the molecular formula C23H30O6Si3 and a molecular weight of 486.75 g/mol. Its IUPAC name is bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane.

Molecular Properties

Compound Namebis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane
PubChem CID90381313
Molecular FormulaC23H30O6Si3
Molecular Weight486.75 g/mol
Exact Mass486.14
IUPAC Namebis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane
SMILESCO[Si](OC)(O[Si](C)(O[Si](OC)(OC)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H30O6Si3/c1-24-31(25-2,22-17-11-7-12-18-22)28-30(5,21-15-9-6-10-16-21)29-32(26-3,27-4)23-19-13-8-14-20-23/h6-20H,1-5H3
InChIKeyOJVWVNQQTBBQPM-UHFFFAOYSA-N
XLogP2.28
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.75
LogP ≤ 52.28
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 bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane?
The IUPAC name of bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane (CID 90381313) is bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane.
What is the SMILES notation for bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane?
The canonical SMILES for bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane is CO[Si](OC)(O[Si](C)(O[Si](OC)(OC)c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane?
The InChIKey is OJVWVNQQTBBQPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30O6Si3/c1-24-31(25-2,22-17-11-7-12-18-22)28-30(5,21-15-9-6-10-16-21)29-32(26-3,27-4)23-19-13-8-14-20-23/h6-20H,1-5H3.
What are the key properties of bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane?
bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane has a molecular weight of 486.75 g/mol, XLogP of 2.28, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane is sourced from PubChem (CID 90381313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).