2,2,2-trifluoro-1-triphenylsilylethanone

C20H15F3OSi — CID 11024701

IUPAC2,2,2-trifluoro-1-triphenylsilylethanone
SMILESO=C(C(F)(F)F)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H15F3OSi/c21-20(22,23)19(24)25(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKeyLQQZKOCPXUISGK-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.83
Rot. Bonds4

About 2,2,2-trifluoro-1-triphenylsilylethanone

2,2,2-trifluoro-1-triphenylsilylethanone (PubChem CID 11024701) has the molecular formula C20H15F3OSi and a molecular weight of 356.42 g/mol. Its IUPAC name is 2,2,2-trifluoro-1-triphenylsilylethanone.

Molecular Properties

Compound Name2,2,2-trifluoro-1-triphenylsilylethanone
PubChem CID11024701
Molecular FormulaC20H15F3OSi
Molecular Weight356.42 g/mol
Exact Mass356.08
IUPAC Name2,2,2-trifluoro-1-triphenylsilylethanone
SMILESO=C(C(F)(F)F)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H15F3OSi/c21-20(22,23)19(24)25(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H
InChIKeyLQQZKOCPXUISGK-UHFFFAOYSA-N
XLogP2.83
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.83
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 2,2,2-trifluoro-1-triphenylsilylethanone?
The IUPAC name of 2,2,2-trifluoro-1-triphenylsilylethanone (CID 11024701) is 2,2,2-trifluoro-1-triphenylsilylethanone.
What is the SMILES notation for 2,2,2-trifluoro-1-triphenylsilylethanone?
The canonical SMILES for 2,2,2-trifluoro-1-triphenylsilylethanone is O=C(C(F)(F)F)[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2,2-trifluoro-1-triphenylsilylethanone?
The InChIKey is LQQZKOCPXUISGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F3OSi/c21-20(22,23)19(24)25(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H.
What are the key properties of 2,2,2-trifluoro-1-triphenylsilylethanone?
2,2,2-trifluoro-1-triphenylsilylethanone has a molecular weight of 356.42 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-1-triphenylsilylethanone is sourced from PubChem (CID 11024701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).