Home Sulfos Pyridinium, 2,6-dichloro-1-fluoro-, 1,1,1-trifluoromethanesulfonate (1:1)

Pyridinium, 2,6-dichloro-1-fluoro-, 1,1,1-trifluoromethanesulfonate (1:1)

CAS No.:
130433-68-0
Catalog Number:
AG000UFP
Molecular Formula:
C6H3Cl2F4NO3S
Molecular Weight:
316.0575
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Product Description
Catalog Number:
AG000UFP
Chemical Name:
Pyridinium, 2,6-dichloro-1-fluoro-, 1,1,1-trifluoromethanesulfonate (1:1)
CAS Number:
130433-68-0
Molecular Formula:
C6H3Cl2F4NO3S
Molecular Weight:
316.0575
MDL Number:
MFCD00191438
IUPAC Name:
2,6-dichloro-1-fluoropyridin-1-ium;trifluoromethanesulfonate
InChI:
InChI=1S/C5H3Cl2FN.CHF3O3S/c6-4-2-1-3-5(7)9(4)8;2-1(3,4)8(5,6)7/h1-3H;(H,5,6,7)/q+1;/p-1
InChI Key:
KDFRVNARKRKXQQ-UHFFFAOYSA-M
SMILES:
[O-]S(=O)(=O)C(F)(F)F.F[n+]1c(Cl)cccc1Cl
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.915g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.048g/mol
Monoisotopic Mass:
314.915g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties