bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane

C39H54O6Si7 — CID 58231824

IUPACbis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane
SMILESC[SiH](C)O[Si](C)(O[Si](C)(O[Si](C)(O[Si](C)(O[Si](C)(O[SiH](C)C)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C39H54O6Si7/c1-46(2)40-48(5,35-25-15-10-16-26-35)42-50(7,37-29-19-12-20-30-37)44-52(9,39-33-23-14-24-34-39)45-51(8,38-31-21-13-22-32-38)43-49(6,41-47(3)4)36-27-17-11-18-28-36/h10-34,46-47H,1-9H3
InChIKeyJOCGLWHTIIPTPD-UHFFFAOYSA-N
MW815.46 g/mol
LogP5.95
Rot. Bonds17

About bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane

bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane (PubChem CID 58231824) has the molecular formula C39H54O6Si7 and a molecular weight of 815.46 g/mol. Its IUPAC name is bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane.

Molecular Properties

Compound Namebis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane
PubChem CID58231824
Molecular FormulaC39H54O6Si7
Molecular Weight815.46 g/mol
Exact Mass814.23
IUPAC Namebis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane
SMILESC[SiH](C)O[Si](C)(O[Si](C)(O[Si](C)(O[Si](C)(O[Si](C)(O[SiH](C)C)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C39H54O6Si7/c1-46(2)40-48(5,35-25-15-10-16-26-35)42-50(7,37-29-19-12-20-30-37)44-52(9,39-33-23-14-24-34-39)45-51(8,38-31-21-13-22-32-38)43-49(6,41-47(3)4)36-27-17-11-18-28-36/h10-34,46-47H,1-9H3
InChIKeyJOCGLWHTIIPTPD-UHFFFAOYSA-N
XLogP5.95
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500815.46
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[bis(dimethylsilyloxy)-phenylsilyl]oxy-bis(dimethylsilyloxy)-phenylsilane
CID 57352431
bis(dimethylsilyloxy)-methyl-phenylsilane;[[dimethyl(trimethylsilyloxy)silyl]oxy-methylsilyl]oxy-diphenyl-trimethylsilyloxysilane
CID 159157709
bis[[2-dimethylsilylethyl(dimethyl)silyl]oxy]-methyl-phenylsilane
CID 123576724
bis[[dimethoxy(phenyl)silyl]oxy]-methyl-phenylsilane
CID 90381313
[bis(dimethylsilyloxy)-phenylsilyl]oxy-bis(dimethylsilyloxy)-phenylsilane;methane;tris[[dimethylsilyloxy(dimethyl)silyl]oxy]-phenylsilane;tris(dimethylsilyloxy)-phenylsilane
CID 159736768
[bis(dimethylsilyloxy)-methylsilyl]oxy-bis(dimethylsilyloxy)silyloxy-diphenylsilane
CID 157245756
hydroxy-methyl-[methyl-(methyl-phenyl-triphenylsilyloxysilyl)oxy-phenylsilyl]oxy-phenylsilane
CID 139767845
bis(dimethylsilyloxy)-[ethoxy(dimethyl)silyl]oxy-phenylsilane
CID 59445484
CID 22292244
CID 22292244
bis[[diethoxy(methyl)silyl]oxy]-methyl-phenylsilane
CID 141467412
dimethyl-(methyl-phenyl-trimethylsilyloxysilyl)oxy-trimethylsilyloxysilane;molecular fluorine;hydrofluoride
CID 163754677
dimethylsilyloxy-[[[dimethylsilyloxy(methyl)silyl]oxy-methylsilyl]oxy-diphenylsilyl]oxy-diphenylsilane
CID 123205762

Frequently Asked Questions

What is the IUPAC name of bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane?
The IUPAC name of bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane (CID 58231824) is bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane.
What is the SMILES notation for bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane?
The canonical SMILES for bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane is C[SiH](C)O[Si](C)(O[Si](C)(O[Si](C)(O[Si](C)(O[Si](C)(O[SiH](C)C)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane?
The InChIKey is JOCGLWHTIIPTPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H54O6Si7/c1-46(2)40-48(5,35-25-15-10-16-26-35)42-50(7,37-29-19-12-20-30-37)44-52(9,39-33-23-14-24-34-39)45-51(8,38-31-21-13-22-32-38)43-49(6,41-47(3)4)36-27-17-11-18-28-36/h10-34,46-47H,1-9H3.
What are the key properties of bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane?
bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane has a molecular weight of 815.46 g/mol, XLogP of 5.95, 17 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis[[(dimethylsilyloxy-methyl-phenylsilyl)oxy-methyl-phenylsilyl]oxy]-methyl-phenylsilane is sourced from PubChem (CID 58231824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).