chempirical

Trimethyl(trifluoroacetato)silane

C5H9F3O2SiCAS 400-53-3186.21 g/mol

Open in Covalent MOL file
SiOOFFF
Alkyl halideSilyl ether

Properties

Molecular formula
C5H9F3O2Si
Molar mass
186.21 g/mol
Exact mass
186.0324 Da
Density
1.08 g/mL
Boiling point
88–90 °C
logP
1.93Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
400-53-3
SMILES
C[Si](C)(C)OC(=O)C(F)(F)F
InChIKey
VIYXXANHGYSBLY-UHFFFAOYSA-N
InChI
InChI=1S/C5H9F3O2Si/c1-11(2,3)10-4(9)5(6,7)8/h1-3H3

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Type any one amount. The others follow from the molar mass and density.

Names and synonyms

6 names
  • Acetic acid, 2,2,2-trifluoro-, trimethylsilyl ester
  • Acetic acid, trifluoro-, trimethylsilyl ester
  • Silanol, trimethyl-, trifluoroacetate
  • Trimethylsilyl trifluoroacetate
  • Trimethyl(trifluoroacetoxy)silane
  • (Trifluoroacetoxy)trimethylsilane

Work with Trimethyl(trifluoroacetato)silane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Trimethylsilyl 2,2-difluoro-2-(fluorosulfonyl)acetate120801-75-453 % similar Trifluoroacetic anhydride407-25-050 % similar Methyl trifluoroacetate431-47-050 % similar Bstfa25561-30-245 % similar Ethyl trifluoroacetate383-63-145 % similar Isopropyl trifluoroacetate400-38-445 % similar Trimethylsilyl acetate2754-27-042 % similar 2,2,2-Trifluoroethyl trifluoroacetate407-38-540 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook