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87988-58-7 | 1h-imidazole, 1-((heptadecafluorooctyl)sulfonyl)-
CAS No: 87988-58-7 Catalog No: AG004LLU MDL No:
Product Description
Catalog Number:
AG004LLU
Chemical Name:
1h-imidazole, 1-((heptadecafluorooctyl)sulfonyl)-
CAS Number:
87988-58-7
Molecular Formula:
C11H3F17N2O2S
Molecular Weight:
550.1916
IUPAC Name:
1-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)imidazole
InChI:
InChI=1S/C11H3F17N2O2S/c12-4(13,6(16,17)8(20,21)10(24,25)26)5(14,15)7(18,19)9(22,23)11(27,28)33(31,32)30-2-1-29-3-30/h1-3H
InChI Key:
CTEBUSUSPQMYLI-UHFFFAOYSA-N
SMILES:
FC(C(C(C(S(=O)(=O)n1cncc1)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F
Properties
Complexity:
844
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
549.964g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
20
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
550.19g/mol
Monoisotopic Mass:
549.964g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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