S-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate
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S-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate
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CAS No:
129946-88-9
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Formula:
C14H8F6O3S2
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Chemical Name:
S-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate
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Synonyms:
S-(TRIFLUOROMETHYL)DIBENZOTHIOPHENIUM TRIFLATE;S-(TRIFLUOROMETHYL)DIBENZOTHIOPHENIUM TRIFLUOROMETHANESULFONATE;S-(TRIFLUOROMETHYL)DIBENZOTHIOPHENIUM TRIFLUOROMETHANESULPHONATE;5-(TRIFLUOROMETHYL)DIBENZOTHIOPHENIUM TRIFLUOROMETHANESULFONATE;5-(TRIFLUOROMETHYL)DIBENZOTHIOPHENIUM TR;5-(TRIFLUOROMETHYL)DIBENZOTHIOPHENIUMTETRAFLUOROMETHANESULFONATE;5-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate,96%;5-(TrifluoroMethyl)-5H-dibenzo[b,d]thiophen-5-iuM trifluoroMethanesulfonate
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CAS No:
Description
S-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate is white to pale brown crystalline powder
S-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate Basic Attributes
402.33
401.981903
DTXSID10380542
29349990
Safety Information
NONH for all modes of transport
3
36/37/38
26-36/37/39-36
Xi
Irritant
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
S-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate Use and Manufacturing
Pd(II)-catalyzed trifluoromethylation. Electrophilic trifluoromethylation in ionic liquids. Used in the stereoselective preparation of trifluoromethylalkynes by trifluoromethylation of terminal alkynes using Umemoto′s reagent and a copper catalyst.
Computed Properties
Molecular Weight:402.3
Hydrogen Bond Acceptor Count:9
Exact Mass:401.98190543
Monoisotopic Mass:401.98190543
Topological Polar Surface Area:66.6
Heavy Atom Count:25
Complexity:412
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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S-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate
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