Home Aminos 1-(Trifluoroacetyl)-4-(dimethylamino)pyridinium trifluoroacetate

1-(Trifluoroacetyl)-4-(dimethylamino)pyridinium trifluoroacetate

CAS No.:
181828-01-3
Catalog Number:
AG00234Q
Molecular Formula:
C11H10F6N2O3
Molecular Weight:
332.1991
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>98.0%(HPLC)(N)
1 week
United States
$241
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Product Description
Catalog Number:
AG00234Q
Chemical Name:
1-(Trifluoroacetyl)-4-(dimethylamino)pyridinium trifluoroacetate
CAS Number:
181828-01-3
Molecular Formula:
C11H10F6N2O3
Molecular Weight:
332.1991
MDL Number:
MFCD01321272
IUPAC Name:
1-[4-(dimethylamino)pyridin-1-ium-1-yl]-2,2,2-trifluoroethanone;2,2,2-trifluoroacetate
InChI:
InChI=1S/C9H10F3N2O.C2HF3O2/c1-13(2)7-3-5-14(6-4-7)8(15)9(10,11)12;3-2(4,5)1(6)7/h3-6H,1-2H3;(H,6,7)/q+1;/p-1
InChI Key:
GOSOPAPEXLJAEZ-UHFFFAOYSA-M
SMILES:
[O-]C(=O)C(F)(F)F.CN(c1cc[n+](cc1)C(=O)C(F)(F)F)C
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.06g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.202g/mol
Monoisotopic Mass:
332.06g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties