tribenzyl-[diethyl(propyl)silyl]oxysilane

C28H38OSi2 — CID 140568536

IUPACtribenzyl-[diethyl(propyl)silyl]oxysilane
SMILESCCC[Si](CC)(CC)O[Si](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C28H38OSi2/c1-4-22-30(5-2,6-3)29-31(23-26-16-10-7-11-17-26,24-27-18-12-8-13-19-27)25-28-20-14-9-15-21-28/h7-21H,4-6,22-25H2,1-3H3
InChIKeySHAQTFBMTWYWCM-UHFFFAOYSA-N
MW446.78 g/mol
LogP7.69
Rot. Bonds12

About tribenzyl-[diethyl(propyl)silyl]oxysilane

tribenzyl-[diethyl(propyl)silyl]oxysilane (PubChem CID 140568536) has the molecular formula C28H38OSi2 and a molecular weight of 446.78 g/mol. Its IUPAC name is tribenzyl-[diethyl(propyl)silyl]oxysilane.

Molecular Properties

Compound Nametribenzyl-[diethyl(propyl)silyl]oxysilane
PubChem CID140568536
Molecular FormulaC28H38OSi2
Molecular Weight446.78 g/mol
Exact Mass446.25
IUPAC Nametribenzyl-[diethyl(propyl)silyl]oxysilane
SMILESCCC[Si](CC)(CC)O[Si](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C28H38OSi2/c1-4-22-30(5-2,6-3)29-31(23-26-16-10-7-11-17-26,24-27-18-12-8-13-19-27)25-28-20-14-9-15-21-28/h7-21H,4-6,22-25H2,1-3H3
InChIKeySHAQTFBMTWYWCM-UHFFFAOYSA-N
XLogP7.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.78
LogP ≤ 57.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

benzyl-diethyl-methoxysilane
CID 13486120
benzyl-ethoxy-diethylsilane
CID 13486124
diphenyl-bis(tripropylsilyloxy)silane
CID 139603904
benzyl(tributyl)silane
CID 14614990
benzyl-(2,2-difluoroethyl)-ethyl-(trifluoromethoxy)silane
CID 90173357
CID 11981400
CID 11981400
trimethoxy(2-phenylethyl)silane;trimethoxy(propyl)silane
CID 70127509
(4-benzylphenoxy)-triethylsilane
CID 102358049
[amino(diethoxy)silyl]methylbenzene
CID 54560418
tribenzyl(tribenzylsilyl)silane
CID 4650468
triethyl(3-phenylprop-1-enoxy)silane
CID 612932
4-[diethyl(phenoxy)silyl]butyl-diethyl-phenoxysilane
CID 66773415

Frequently Asked Questions

What is the IUPAC name of tribenzyl-[diethyl(propyl)silyl]oxysilane?
The IUPAC name of tribenzyl-[diethyl(propyl)silyl]oxysilane (CID 140568536) is tribenzyl-[diethyl(propyl)silyl]oxysilane.
What is the SMILES notation for tribenzyl-[diethyl(propyl)silyl]oxysilane?
The canonical SMILES for tribenzyl-[diethyl(propyl)silyl]oxysilane is CCC[Si](CC)(CC)O[Si](Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of tribenzyl-[diethyl(propyl)silyl]oxysilane?
The InChIKey is SHAQTFBMTWYWCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H38OSi2/c1-4-22-30(5-2,6-3)29-31(23-26-16-10-7-11-17-26,24-27-18-12-8-13-19-27)25-28-20-14-9-15-21-28/h7-21H,4-6,22-25H2,1-3H3.
What are the key properties of tribenzyl-[diethyl(propyl)silyl]oxysilane?
tribenzyl-[diethyl(propyl)silyl]oxysilane has a molecular weight of 446.78 g/mol, XLogP of 7.69, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tribenzyl-[diethyl(propyl)silyl]oxysilane is sourced from PubChem (CID 140568536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).