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N,N,N-Triethyl-2,2,2-trifluoroethanaminium trifluoromethanesulfonate

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Name

N,N,N-Triethyl-2,2,2-trifluoroethanaminium trifluoromethanesulfonate

EINECS N/A
CAS No. 380230-73-9 Density N/A
PSA 65.58000 LogP 3.55740
Solubility N/A Melting Point N/A
Formula C9H17F6NO3S Boiling Point N/A
Molecular Weight 333.29 Flash Point N/A
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 380230-73-9 (2,2,2-TRIFLUOROETHYL TRIETHYLAMMONIUM TRIFLATE) Hazard Symbols CorrosiveC
Synonyms

2,2,2-Trifluoroethyl triethylammonium triflate;2,2,2-Trifluoroethyl triethylammonium trifluoromethanesulfonate;2,2,2-Trifluoroethyl triethylammonium trifluoromethanesulphonate;

 

N,N,N-Triethyl-2,2,2-trifluoroethanaminium trifluoromethanesulfonate Specification

The CAS register number of N,N,N-Triethyl-2,2,2-trifluoroethanaminium trifluoromethanesulfonate is 380230-73-9. It also can be called as 2,2,2-Trifluoroethyl triethylammonium triflate. The molecular formula about this chemical is C9H17F6NO3S and the molecular weight is 333.29.

Physical properties about N,N,N-Triethyl-2,2,2-trifluoroethanaminium trifluoromethanesulfonate are: (1)ACD/LogP: -2.40; (2)ACD/LogD (pH 5.5): -2.4; (3)ACD/LogD (pH 7.4): -2.4; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1.19; (7)ACD/KOC (pH 7.4): 1.19; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 4.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin and it may destroy living tissue on contact. If you want to use it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)C[N+](CC)(CC)CC.FC(F)(F)S([O-])(=O)=O
(2)InChI: InChI=1/C8H17F3N.CHF3O3S/c1-4-12(5-2,6-3)7-8(9,10)11;2-1(3,4)8(5,6)7/h4-7H2,1-3H3;(H,5,6,7)/q+1;/p-1
(3)InChIKey: VDBVQAPVHZQGQS-REWHXWOFAF
(4)Std. InChI: InChI=1S/C8H17F3N.CHF3O3S/c1-4-12(5-2,6-3)7-8(9,10)11;2-1(3,4)8(5,6)7/h4-7H2,1-3H3(H,5,6,7)/q+1;/p-1
(5)Std. InChIKey: VDBVQAPVHZQGQS-UHFFFAOYSA-M

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