N-(2-Pyridyl)bis(trifluoromethanesulfonimide) - CAS 145100-50-1
Catalog: |
BB009879 |
Product Name: |
N-(2-Pyridyl)bis(trifluoromethanesulfonimide) |
CAS: |
145100-50-1 |
Synonyms: |
1,1,1-trifluoro-N-pyridin-2-yl-N-(trifluoromethylsulfonyl)methanesulfonamide |
IUPAC Name: | 1,1,1-trifluoro-N-pyridin-2-yl-N-(trifluoromethylsulfonyl)methanesulfonamide |
Description: | N-(2-Pyridyl)bis(trifluoromethanesulfonimide) (CAS# 145100-50-1) is an intermediate used in the synthesis of aryl triflates and vinyl triflates. |
Molecular Weight: | 358.24 |
Molecular Formula: | C7H4F6N2O4S2 |
Canonical SMILES: | C1=CC=NC(=C1)N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F |
InChI: | InChI=1S/C7H4F6N2O4S2/c8-6(9,10)20(16,17)15(5-3-1-2-4-14-5)21(18,19)7(11,12)13/h1-4H |
InChI Key: | DXLQEJHUQKKSRB-UHFFFAOYSA-N |
Boiling Point: | 80 °C (0.25 torr) |
Melting Point: | 40-42 °C |
Purity: | 95 % |
Density: | 1.832 g/cm3 |
Appearance: | White to orange powder or crystals |
Storage: | Refrigerator (+4 °C) |
MDL: | MFCD00191834 |
LogP: | 3.74880 |
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 |
Publication Number | Title | Priority Date |
CN-112062715-A | Novel lithium trifluoromethanesulfonamide salt and preparation method and application thereof | 20200827 |
CN-111606846-A | N' -trifluoromethanesulfonyl N heteroaromatic amine compound and preparation method thereof | 20200512 |
WO-2021211380-A1 | Crystalline ret inhibitor | 20200417 |
WO-2021174176-A1 | Pyridazine dervatives for modulating nucleic acid splicing | 20200228 |
WO-2021141041-A1 | Therapeutic agent for tauopathies | 20200107 |
PMID | Publication Date | Title | Journal |
12971788 | 20030922 | Quaternary salts containing the pentafluorosulfanyl (SF5) group | Inorganic chemistry |
Complexity: | 526 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 357.95166793 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 12 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 357.95166793 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 101 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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Pyridines
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