2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone

C11H27F3OSi4 — CID 553483

IUPAC2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone
SMILESC[Si](C)(C)[Si](C(=O)C(F)(F)F)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C11H27F3OSi4/c1-16(2,3)19(17(4,5)6,18(7,8)9)10(15)11(12,13)14/h1-9H3
InChIKeyYZPBGNQKCOMGON-UHFFFAOYSA-N
MW344.67 g/mol
LogP4.36
Rot. Bonds4

About 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone

2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone (PubChem CID 553483) has the molecular formula C11H27F3OSi4 and a molecular weight of 344.67 g/mol. Its IUPAC name is 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone.

Molecular Properties

Compound Name2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone
PubChem CID553483
Molecular FormulaC11H27F3OSi4
Molecular Weight344.67 g/mol
Exact Mass344.11
IUPAC Name2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone
SMILESC[Si](C)(C)[Si](C(=O)C(F)(F)F)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C11H27F3OSi4/c1-16(2,3)19(17(4,5)6,18(7,8)9)10(15)11(12,13)14/h1-9H3
InChIKeyYZPBGNQKCOMGON-UHFFFAOYSA-N
XLogP4.36
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.67
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone?
The IUPAC name of 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone (CID 553483) is 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone.
What is the SMILES notation for 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone?
The canonical SMILES for 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone is C[Si](C)(C)[Si](C(=O)C(F)(F)F)([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone?
The InChIKey is YZPBGNQKCOMGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27F3OSi4/c1-16(2,3)19(17(4,5)6,18(7,8)9)10(15)11(12,13)14/h1-9H3.
What are the key properties of 2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone?
2,2,2-trifluoro-1-tris(trimethylsilyl)silylethanone has a molecular weight of 344.67 g/mol, XLogP of 4.36, 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-tris(trimethylsilyl)silylethanone is sourced from PubChem (CID 553483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).