tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane

C43H48O7Si4 — CID 87832768

IUPACtris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane
SMILESCO[Si](OC)(c1ccccc1)c1ccc([Si](OC)(c2ccc([Si](OC)(OC)c3ccccc3)cc2)c2ccc([Si](OC)(OC)c3ccccc3)cc2)cc1
InChIInChI=1S/C43H48O7Si4/c1-44-51(35-23-29-41(30-24-35)52(45-2,46-3)38-17-11-8-12-18-38,36-25-31-42(32-26-36)53(47-4,48-5)39-19-13-9-14-20-39)37-27-33-43(34-28-37)54(49-6,50-7)40-21-15-10-16-22-40/h8-34H,1-7H3
InChIKeyMEFTYZHLLJAOTR-UHFFFAOYSA-N
MW789.19 g/mol
LogP1.85
Rot. Bonds16

About tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane

tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane (PubChem CID 87832768) has the molecular formula C43H48O7Si4 and a molecular weight of 789.19 g/mol. Its IUPAC name is tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane.

Molecular Properties

Compound Nametris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane
PubChem CID87832768
Molecular FormulaC43H48O7Si4
Molecular Weight789.19 g/mol
Exact Mass788.25
IUPAC Nametris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane
SMILESCO[Si](OC)(c1ccccc1)c1ccc([Si](OC)(c2ccc([Si](OC)(OC)c3ccccc3)cc2)c2ccc([Si](OC)(OC)c3ccccc3)cc2)cc1
InChIInChI=1S/C43H48O7Si4/c1-44-51(35-23-29-41(30-24-35)52(45-2,46-3)38-17-11-8-12-18-38,36-25-31-42(32-26-36)53(47-4,48-5)39-19-13-9-14-20-39)37-27-33-43(34-28-37)54(49-6,50-7)40-21-15-10-16-22-40/h8-34H,1-7H3
InChIKeyMEFTYZHLLJAOTR-UHFFFAOYSA-N
XLogP1.85
TPSA64.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms54
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500789.19
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

bis[[methoxy(diphenyl)silyl]oxy]-diphenylsilane
CID 54456197
dimethoxy(diphenyl)silane;methanol;trimethoxy(phenyl)silane
CID 160738945
[diphenyl(triphenylsilyloxy)silyl]oxy-methoxy-[[methoxy(diphenyl)silyl]oxy-diphenylsilyl]oxy-phenylsilane
CID 140689464
[dimethyl(phenyl)silyl]oxy-methoxy-diphenylsilane
CID 140654649
dimethoxy(diphenyl)silane;triethoxy(phenyl)silane
CID 174286071
trimethoxy(phenyl)silane;hydrochloride
CID 140901295
[diphenyl(triphenylsilyloxy)silyl]oxy-[[[[[[diphenyl(triphenylsilyloxy)silyl]oxy-diphenylsilyl]oxy-diphenylsilyl]oxy-diphenylsilyl]oxy-diphenylsilyl]oxy-diphenylsilyl]oxy-diphenylsilane
CID 139707283
methoxy-diphenyl-propoxysilane
CID 22955915
bis(4-ethylphenyl)-dimethoxysilane
CID 57068446
(2-methylpropan-2-yl)oxy-[4-[(2-methylpropan-2-yl)oxy-diphenylsilyl]phenyl]-diphenylsilane
CID 87143933
CID 18350411
CID 18350411
2-[dimethyl(triphenylsilyloxy)silyl]ethyl-dimethyl-triphenylsilyloxysilane
CID 140828433

Frequently Asked Questions

What is the IUPAC name of tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane?
The IUPAC name of tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane (CID 87832768) is tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane.
What is the SMILES notation for tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane?
The canonical SMILES for tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane is CO[Si](OC)(c1ccccc1)c1ccc([Si](OC)(c2ccc([Si](OC)(OC)c3ccccc3)cc2)c2ccc([Si](OC)(OC)c3ccccc3)cc2)cc1.
What is the InChIKey of tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane?
The InChIKey is MEFTYZHLLJAOTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H48O7Si4/c1-44-51(35-23-29-41(30-24-35)52(45-2,46-3)38-17-11-8-12-18-38,36-25-31-42(32-26-36)53(47-4,48-5)39-19-13-9-14-20-39)37-27-33-43(34-28-37)54(49-6,50-7)40-21-15-10-16-22-40/h8-34H,1-7H3.
What are the key properties of tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane?
tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane has a molecular weight of 789.19 g/mol, XLogP of 1.85, 16 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for tris[4-[dimethoxy(phenyl)silyl]phenyl]-methoxysilane is sourced from PubChem (CID 87832768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).