Pyridinium trifluoromethanesulfonate - CAS 52193-54-1
Catalog: |
BB027736 |
Product Name: |
Pyridinium trifluoromethanesulfonate |
CAS: |
52193-54-1 |
Synonyms: |
pyridin-1-ium;trifluoromethanesulfonate |
IUPAC Name: | pyridin-1-ium;trifluoromethanesulfonate |
Description: | Pyridinium trifluoromethanesulfonate (CAS# 52193-54-1) is a useful research chemical. |
Molecular Weight: | 229.18 |
Molecular Formula: | C6H6F3NO3S |
Canonical SMILES: | C1=CC=[NH+]C=C1.C(F)(F)(F)S(=O)(=O)[O-] |
InChI: | InChI=1S/C5H5N.CHF3O3S/c1-2-4-6-5-3-1;2-1(3,4)8(5,6)7/h1-5H;(H,5,6,7) |
InChI Key: | YWVYZMVYXAVAKS-UHFFFAOYSA-N |
Boiling Point: | 162 ℃ at 760 mmHg |
Purity: | > 98.0 % (T) |
MDL: | MFCD00274656 |
LogP: | 2.55640 |
GHS Hazard Statement: | H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112174876-A | Preparation method and application of pyridine ionic liquid acidic catalyst | 20201014 |
WO-2021200883-A1 | Resist underlayer film forming composition in which modification of crosslinking agent is suppressed | 20200331 |
WO-2021200769-A1 | Chemical-resistant protective film | 20200330 |
CN-111029654-A | Electrolyte and lithium ion battery using same | 20191220 |
WO-2021095874-A1 | Method for producing oligonucleic acid compound | 20191113 |
PMID | Publication Date | Title | Journal |
19805883 | 20091001 | Coulombic interactions, hydrogen bonding and supramolecular chirality in pyridinium trifluoromethanesulfonate | Acta crystallographica. Section C, Crystal structure communications |
16097833 | 20050822 | Practical synthetic routes to solvates of U(OTf)3: X-ray crystal structure of [U(OTf)3(MeCN)3]n, a unique U(III) coordination polymer | Inorganic chemistry |
12240023 | 20011207 | Si-BEZA--catalytic pyridinium triflate: a mild and powerful agent for the silylation of alcohols | Chemical communications (Cambridge, England) |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.00204871 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.00204871 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 79.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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