2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane

C11H20O3Si3 — CID 28856

IUPAC2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane
SMILESC[Si]1(C)O[Si](C)(C)O[Si](C)(c2ccccc2)O1
InChIInChI=1S/C11H20O3Si3/c1-15(2)12-16(3,4)14-17(5,13-15)11-9-7-6-8-10-11/h6-10H,1-5H3
InChIKeyJITAAWJDVCUJPO-UHFFFAOYSA-N
MW284.54 g/mol
LogP2.43
Rot. Bonds1

About 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane

2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane (PubChem CID 28856) has the molecular formula C11H20O3Si3 and a molecular weight of 284.54 g/mol. Its IUPAC name is 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane.

Molecular Properties

Compound Name2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane
PubChem CID28856
Molecular FormulaC11H20O3Si3
Molecular Weight284.54 g/mol
Exact Mass284.07
IUPAC Name2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane
SMILESC[Si]1(C)O[Si](C)(C)O[Si](C)(c2ccccc2)O1
InChIInChI=1S/C11H20O3Si3/c1-15(2)12-16(3,4)14-17(5,13-15)11-9-7-6-8-10-11/h6-10H,1-5H3
InChIKeyJITAAWJDVCUJPO-UHFFFAOYSA-N
XLogP2.43
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.54
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane?
The IUPAC name of 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane (CID 28856) is 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane.
What is the SMILES notation for 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane?
The canonical SMILES for 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane is C[Si]1(C)O[Si](C)(C)O[Si](C)(c2ccccc2)O1.
What is the InChIKey of 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane?
The InChIKey is JITAAWJDVCUJPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3Si3/c1-15(2)12-16(3,4)14-17(5,13-15)11-9-7-6-8-10-11/h6-10H,1-5H3.
What are the key properties of 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane?
2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane has a molecular weight of 284.54 g/mol, XLogP of 2.43, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4,6-pentamethyl-6-phenyl-1,3,5,2,4,6-trioxatrisilinane is sourced from PubChem (CID 28856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).