Tetrabutylammonium Trifluoromethanesulfonate - CAS 35895-70-6
Catalog: |
BB022797 |
Product Name: |
Tetrabutylammonium Trifluoromethanesulfonate |
CAS: |
35895-70-6 |
Synonyms: |
tetrabutylammonium;trifluoromethanesulfonate; tetrabutylazanium;trifluoromethanesulfonate |
IUPAC Name: | tetrabutylazanium;trifluoromethanesulfonate |
Description: | Tetrabutylammonium Trifluoromethanesulfonate (CAS# 35895-70-6) is a useful research chemical. |
Molecular Weight: | 391.53 |
Molecular Formula: | C17H36F3NO3S |
Canonical SMILES: | CCCC[N+](CCCC)(CCCC)CCCC.C(F)(F)(F)S(=O)(=O)[O-] |
InChI: | InChI=1S/C16H36N.CHF3O3S/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1(3,4)8(5,6)7/h5-16H2,1-4H3;(H,5,6,7)/q+1;/p-1 |
InChI Key: | YNJQKNVVBBIPBA-UHFFFAOYSA-M |
Melting Point: | 113 °C |
Purity: | > 98.0 % (T) |
Appearance: | White to almost white powder to crystal |
Storage: | Store under inert gas |
MDL: | MFCD00042585 |
LogP: | 6.13580 |
Refractive Index: | 1.42 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22838847 | 20120823 | Molecular and system parameters governing mass and charge transport in polar liquids and electrolytes | The journal of physical chemistry. B |
22145961 | 20120112 | Temperature dependence of ion transport in dilute tetrabutylammonium triflate-acetate solutions and self-diffusion in pure acetate liquids | The journal of physical chemistry. B |
21958388 | 20111103 | Frequency-domain investigation of the ionic mobility of triflate salts in tetrahydrofuran | The journal of physical chemistry. B |
21315277 | 20110201 | [11C]GR103545: novel one-pot radiosynthesis with high specific activity | Nuclear medicine and biology |
20932024 | 20101101 | Iridium metal complexes containing N-heterocyclic carbene ligands for blue-light-emitting electrochemical cells | Inorganic chemistry |
Complexity: | 261 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 391.23679967 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 391.23679967 |
Rotatable Bond Count: | 12 |
Topological Polar Surface Area: | 65.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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