2-fluoro-1-tri(propan-2-yl)silylethanone

C11H23FOSi — CID 86211349

IUPAC2-fluoro-1-tri(propan-2-yl)silylethanone
SMILESCC(C)[Si](C(=O)CF)(C(C)C)C(C)C
InChIInChI=1S/C11H23FOSi/c1-8(2)14(9(3)4,10(5)6)11(13)7-12/h8-10H,7H2,1-6H3
InChIKeyPYDUWXOEQGENKG-UHFFFAOYSA-N
MW218.39 g/mol
LogP3.74
Rot. Bonds5

About 2-fluoro-1-tri(propan-2-yl)silylethanone

2-fluoro-1-tri(propan-2-yl)silylethanone (PubChem CID 86211349) has the molecular formula C11H23FOSi and a molecular weight of 218.39 g/mol. Its IUPAC name is 2-fluoro-1-tri(propan-2-yl)silylethanone.

Molecular Properties

Compound Name2-fluoro-1-tri(propan-2-yl)silylethanone
PubChem CID86211349
Molecular FormulaC11H23FOSi
Molecular Weight218.39 g/mol
Exact Mass218.15
IUPAC Name2-fluoro-1-tri(propan-2-yl)silylethanone
SMILESCC(C)[Si](C(=O)CF)(C(C)C)C(C)C
InChIInChI=1S/C11H23FOSi/c1-8(2)14(9(3)4,10(5)6)11(13)7-12/h8-10H,7H2,1-6H3
InChIKeyPYDUWXOEQGENKG-UHFFFAOYSA-N
XLogP3.74
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.39
LogP ≤ 53.74
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

1-[Ditert-butyl(fluoro)silyl]ethanone
CID 87707839
Acetyl(tert-butyl)dimethylsilane
CID 11367157
2,2,2-Trifluoro-1-tri(propan-2-yl)silylethanone
CID 18454915
2,2,2-Trifluoro-1-tri(propan-2-yl)silylethanone;hydrate
CID 87125637
1-[Bis(2-fluoroacetyl)-propylsilyl]-2-fluoroethanone
CID 140249712
1-(Triethylsilyl)ethan-1-one
CID 14400427
1-Tri(propan-2-yl)silylpropan-1-one
CID 3781751
(Difluoroacetyl)tris(isopropyl)silane
CID 11447724
1-[Tert-butyl(dimethyl)silyl]-2,2-difluoroethanone
CID 11480993
2,2-Difluoro-1-triethylsilylethanone
CID 12033500
2-Fluoro-1-triethylsilylethanone
CID 86003424
1-[Tert-butyl(dimethyl)silyl]-2-fluoroethanone
CID 86003428

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-tri(propan-2-yl)silylethanone?
The IUPAC name of 2-fluoro-1-tri(propan-2-yl)silylethanone (CID 86211349) is 2-fluoro-1-tri(propan-2-yl)silylethanone.
What is the SMILES notation for 2-fluoro-1-tri(propan-2-yl)silylethanone?
The canonical SMILES for 2-fluoro-1-tri(propan-2-yl)silylethanone is CC(C)[Si](C(=O)CF)(C(C)C)C(C)C.
What is the InChIKey of 2-fluoro-1-tri(propan-2-yl)silylethanone?
The InChIKey is PYDUWXOEQGENKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FOSi/c1-8(2)14(9(3)4,10(5)6)11(13)7-12/h8-10H,7H2,1-6H3.
What are the key properties of 2-fluoro-1-tri(propan-2-yl)silylethanone?
2-fluoro-1-tri(propan-2-yl)silylethanone has a molecular weight of 218.39 g/mol, XLogP of 3.74, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-tri(propan-2-yl)silylethanone is sourced from PubChem (CID 86211349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).