(Trimethylsilyl)methyl trifluoromethanesulfonate

C5H11F3O3SSiCAS 64035-64-9236.28 g/mol

Open in Covalent MOL file
SiOSOOFFF
Alkyl halideSulfonate ester

Properties

Molecular formula
C5H11F3O3SSi
Molar mass
236.28 g/mol
Exact mass
236.0150 Da
logP
1.73Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Hazards

Danger
Flammable (GHS02)Corrosive (GHS05)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, P501

Identifiers

CAS number
64035-64-9
SMILES
C[Si](C)(C)COS(=O)(=O)C(F)(F)F
InChIKey
VMDMAAJZSXXCQV-UHFFFAOYSA-N
InChI
InChI=1S/C5H11F3O3SSi/c1-13(2,3)4-11-12(9,10)5(6,7)8/h4H2,1-3H3

Weigh it out

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Work with (Trimethylsilyl)methyl trifluoromethanesulfonate

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl trifluoromethanesulphonate425-75-255 % similar Trimethylsilyl trifluoromethanesulfonate27607-77-850 % similar 2,2,2-Trifluoroethyl trifluoromethanesulfonate6226-25-150 % similar 2,2-Difluoroethyl trifluoromethanesulfonate74427-22-847 % similar Triethylsilyl 1,1,1-trifluoromethanesulfonate79271-56-045 % similar Triisopropylsilyl trifluoromethanesulfonate80522-42-545 % similar Methyl trifluoromethanesulfonate333-27-745 % similar Trifluoromethanesulfonic anhydride358-23-644 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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