Tetraethylammonium trifluoromethanesulfonate

C9H20F3NO3SCAS 35895-69-3279.32 g/mol

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Alkyl halideQuaternary ammoniumSulfonic acid

Properties

Molecular formula
C9H20F3NO3S
Molar mass
279.32 g/mol
Exact mass
279.1116 Da
logP
1.93Crippen estimate
Polar surface area
57.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
35895-69-3
SMILES
CC[N+](CC)(CC)CC.O=S(=O)([O-])C(F)(F)F
InChIKey
PUZYNDBTWXJXKN-UHFFFAOYSA-M
InChI
InChI=1S/C8H20N.CHF3O3S/c1-5-9(6-2,7-3)8-4;2-1(3,4)8(5,6)7/h5-8H2,1-4H3;(H,5,6,7)/q+1;/p-1

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

Names and synonyms

6 names
  • Ethanaminium, N,N,N-triethyl-, 1,1,1-trifluoromethanesulfonate (1:1)
  • Ethanaminium, N,N,N-triethyl-, salt with trifluoromethanesulfonic acid (1:1)
  • Methanesulfonic acid, trifluoro-, ion(1-), N,N,N-triethylethanaminium
  • Tetraethylammonium perfluoromethylsulfonate
  • Tetraethylammonium triflate
  • Tetraethylammonium trifluoromethanesulphonate

Work with Tetraethylammonium 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Triflic acid1493-13-6Free acid Lithium triflate33454-82-9Salt Tetraethylammonium bromide71-91-0Salt Zinc triflate54010-75-2Salt Copper(II) triflate34946-82-2Salt Silver trifluoromethanesulfonate2923-28-6Salt Scandium(III) trifluoromethanesulfonate144026-79-9Salt Tetraethylammonium chloride56-34-8Salt N-Fluoropyridinium triflate107263-95-6Salt Tetraethylammonium iodide68-05-3Salt Tetraethylammonium hydroxide77-98-5Salt 1-Butyl-3-methylimidazolium trifluoromethanesulfonate174899-66-2Salt

Similar compounds

Hafnium(IV) trifluoromethanesulfonate161337-67-356 % similar Bis(1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate99326-34-850 % similar Ethyl trifluoromethanesulphonate425-75-232 % similar Trifluoromethanesulfonyl chloride421-83-030 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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