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220122-79-2

CAS No.:
66003-78-9
Catalog Number:
AG006LKN
Molecular Formula:
C19H15F3O3S2
Molecular Weight:
412.4458
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Product Description
Catalog Number:
AG006LKN
Chemical Name:
220122-79-2
CAS Number:
66003-78-9
Molecular Formula:
C19H15F3O3S2
Molecular Weight:
412.4458
MDL Number:
MFCD01940916
IUPAC Name:
trifluoromethanesulfonate;triphenylsulfanium
InChI:
InChI=1S/C18H15S.CHF3O3S/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2-1(3,4)8(5,6)7/h1-15H;(H,5,6,7)/q+1;/p-1
InChI Key:
FAYMLNNRGCYLSR-UHFFFAOYSA-M
SMILES:
c1ccc(cc1)[S+](c1ccccc1)c1ccccc1.FC(S(=O)(=O)[O-])(F)F
Properties
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.041g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
412.441g/mol
Monoisotopic Mass:
412.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties