1-triphenylsilylethanone

C20H18OSi — CID 5226386

IUPAC1-triphenylsilylethanone
SMILESCC(=O)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18OSi/c1-17(21)22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,1H3
InChIKeyGVJSGABMOHZNSD-UHFFFAOYSA-N
MW302.45 g/mol
LogP2.29
Rot. Bonds4

About 1-triphenylsilylethanone

1-triphenylsilylethanone (PubChem CID 5226386) has the molecular formula C20H18OSi and a molecular weight of 302.45 g/mol. Its IUPAC name is 1-triphenylsilylethanone.

Molecular Properties

Compound Name1-triphenylsilylethanone
PubChem CID5226386
Molecular FormulaC20H18OSi
Molecular Weight302.45 g/mol
Exact Mass302.11
IUPAC Name1-triphenylsilylethanone
SMILESCC(=O)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18OSi/c1-17(21)22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,1H3
InChIKeyGVJSGABMOHZNSD-UHFFFAOYSA-N
XLogP2.29
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.45
LogP ≤ 52.29
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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Frequently Asked Questions

What is the IUPAC name of 1-triphenylsilylethanone?
The IUPAC name of 1-triphenylsilylethanone (CID 5226386) is 1-triphenylsilylethanone.
What is the SMILES notation for 1-triphenylsilylethanone?
The canonical SMILES for 1-triphenylsilylethanone is CC(=O)[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 1-triphenylsilylethanone?
The InChIKey is GVJSGABMOHZNSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18OSi/c1-17(21)22(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16H,1H3.
What are the key properties of 1-triphenylsilylethanone?
1-triphenylsilylethanone has a molecular weight of 302.45 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-triphenylsilylethanone is sourced from PubChem (CID 5226386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).