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Description
Ionic liquid and NHC precatalyst
Synonyms
(OH)2Im-NTf2
IUPAC Name
bis(trifluoromethylsulfonyl)azanide;1,3-dihydroxyimidazol-1-ium
Molecular Weight
381.23
Molecular Formula
C3H5N2O2•C2F6NO4S2
Canonical SMILES
C1=C[N+](=CN1O)O.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
InChI
1S/C3H5N2O2.C2F6NO4S2/c6-4-1-2-5(7)3-4;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h1-3,6-7H;/q+1;-1
InChI Key
SWVAEQIBLYMHDX-UHFFFAOYSA-N
Melting Point
75-80 °C (lit.)
Flash Point
Not applicable
Purity
98%
Appearance
powder
Storage
room temperature, dry
Complexity
434
Covalently-Bonded Unit Count
2
Empirical Formula
C5H5F6N3O6S2
Exact Mass
380.952396g/mol
Formal Charge
0
H-Bond Acceptor
13
H-Bond Donor
2
Heavy Atom Count
22
MDL Number
MFCD11656053
Monoisotopic Mass
380.952396g/mol
Refractive Index
n20/D 1.4275
Rotatable Bond Count
2
