tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane

C42H42OSi2 — CID 87172933

IUPACtris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane
SMILESCc1ccccc1[Si](O[Si](c1ccccc1C)(c1ccccc1C)c1ccccc1C)(c1ccccc1C)c1ccccc1C
InChIInChI=1S/C42H42OSi2/c1-31-19-7-13-25-37(31)44(38-26-14-8-20-32(38)2,39-27-15-9-21-33(39)3)43-45(40-28-16-10-22-34(40)4,41-29-17-11-23-35(41)5)42-30-18-12-24-36(42)6/h7-30H,1-6H3
InChIKeyQNNXKNMJIVECKB-UHFFFAOYSA-N
MW618.97 g/mol
LogP6.19
Rot. Bonds8

About tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane

tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane (PubChem CID 87172933) has the molecular formula C42H42OSi2 and a molecular weight of 618.97 g/mol. Its IUPAC name is tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane.

Molecular Properties

Compound Nametris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane
PubChem CID87172933
Molecular FormulaC42H42OSi2
Molecular Weight618.97 g/mol
Exact Mass618.28
IUPAC Nametris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane
SMILESCc1ccccc1[Si](O[Si](c1ccccc1C)(c1ccccc1C)c1ccccc1C)(c1ccccc1C)c1ccccc1C
InChIInChI=1S/C42H42OSi2/c1-31-19-7-13-25-37(31)44(38-26-14-8-20-32(38)2,39-27-15-9-21-33(39)3)43-45(40-28-16-10-22-34(40)4,41-29-17-11-23-35(41)5)42-30-18-12-24-36(42)6/h7-30H,1-6H3
InChIKeyQNNXKNMJIVECKB-UHFFFAOYSA-N
XLogP6.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500618.97
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

1-[amino(dimethyl)silyl]-2-methylbenzene
CID 149225520
(2-methylphenyl)-triphenoxysilane
CID 69286359
triethyl-(2-methylphenyl)silane
CID 66868516
methoxy-(2-methylphenyl)-di(propan-2-yl)silane
CID 13486116
1,2-xylene
CID 173422016
benzene;1,2-xylene
CID 161464493
1,2-xylene;trihydrochloride
CID 70594732
1,2-xylene;zirconium
CID 174354618
vanadium;1,2-xylene
CID 143581691
1,2-xylene;tetrahydrobromide
CID 172843014
silver;1,2-xylene
CID 158486133
azane;1,2-xylene
CID 174280305

Frequently Asked Questions

What is the IUPAC name of tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane?
The IUPAC name of tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane (CID 87172933) is tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane.
What is the SMILES notation for tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane?
The canonical SMILES for tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane is Cc1ccccc1[Si](O[Si](c1ccccc1C)(c1ccccc1C)c1ccccc1C)(c1ccccc1C)c1ccccc1C.
What is the InChIKey of tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane?
The InChIKey is QNNXKNMJIVECKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H42OSi2/c1-31-19-7-13-25-37(31)44(38-26-14-8-20-32(38)2,39-27-15-9-21-33(39)3)43-45(40-28-16-10-22-34(40)4,41-29-17-11-23-35(41)5)42-30-18-12-24-36(42)6/h7-30H,1-6H3.
What are the key properties of tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane?
tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane has a molecular weight of 618.97 g/mol, XLogP of 6.19, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-methylphenyl)-tris(2-methylphenyl)silyloxysilane is sourced from PubChem (CID 87172933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).