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Home > Fluorides > 1097778-74-9
1097778-74-9 | 6-(Trifluoromethyl)pyridin-3-yl trifluoromethanesulfonate
CAS No: 1097778-74-9 Catalog No: AG01F76K MDL No:
Product Description
Catalog Number:
AG01F76K
Chemical Name:
6-(Trifluoromethyl)pyridin-3-yl trifluoromethanesulfonate
CAS Number:
1097778-74-9
Molecular Formula:
C7H3F6NO3S
Molecular Weight:
295.1590
IUPAC Name:
[6-(trifluoromethyl)pyridin-3-yl] trifluoromethanesulfonate
InChI:
InChI=1S/C7H3F6NO3S/c8-6(9,10)5-2-1-4(3-14-5)17-18(15,16)7(11,12)13/h1-3H
InChI Key:
YXTDRVFQMVNSGJ-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cn1)OS(=O)(=O)C(F)(F)F)(F)F
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.974g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.155g/mol
Monoisotopic Mass:
294.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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